SCHEMBL20399310

SCHEMBL20399310

CC(C)(O)Cc1ccc(CCC=O)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.36
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
ESR2 Q92731 2/20 0.33
BLM P54132 1/20 0.33
SLC13A5 Q86YT5 2/20 0.32
FDPS P14324 1/20 0.32
PPARA Q07869 1/20 0.31
SLC6A2 P23975 1/20 0.31
HTR2A P28223 1/20 0.31
SLC6A4 P31645 1/20 0.31
HRH1 P35367 1/20 0.31
HTR2B P41595 1/20 0.31
CHRNA4 P43681 1/20 0.31
SLC6A3 Q01959 1/20 0.31
MMP8 P22894 1/20 0.30
GPR84 Q9NQS5 1/20 0.30
ESRRG P62508 1/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28208701 0.85 HRH3 (0.40) SLC13A5PPARASLC6A2ALDH1A1
SCHEMBL157134 0.84 ESR1 (0.48) ESR1THRATHRBESR2BLM
SCHEMBL18382147 0.82 CHRM2 (0.36) PPARA
SCHEMBL30542914 0.82 CHRM2 (0.36) PPARA
SCHEMBL14451865 0.82 ESR1 (0.40) ESR1THRATHRBESR2BLM
SCHEMBL31320138 0.79 RXRA (0.31)
SCHEMBL18382219 0.79 RXRA (0.31)
SCHEMBL9671868 0.78 HIF1A (0.37) ESR1THRBESR2ALDH1A1
SCHEMBL1864936 0.76 TP53 (0.52) SLC13A5GPR84ESRRGTP53TSHR
SCHEMBL66122 0.76 TP53 (0.52) SLC13A5GPR84ESRRGTP53TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 50 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120091758-A Arthropod control composition 弗门尼舍有限公司 2025-06-03 CN claimed
CN-119486703-A Fragrance composition with lasting fragrance appearance 弗门尼舍有限公司 2025-02-18 CN claimed
CN-119403908-A Method for enhancing psychological performance and composition for use in the method 弗门尼舍有限公司 2025-02-07 CN claimed
EP-4447678-A1 ARTHROPOD CONTROL COMPOSITIONS Firmenich SA (CH) 2024-10-23 EP claimed
CN-118555909-A Arthropod control composition 弗门尼舍有限公司 2024-08-27 CN claimed
CN-110177861-B Composition with muguet smell 弗门尼舍有限公司 2023-07-28 CN claimed
WO-2023139051-A1 ARTHROPOD CONTROL COMPOSITIONS FIRMENICH SA (CH) 2023-07-27 WO claimed
CN-110225964-B Composition with muguet smell 弗门尼舍有限公司 2023-05-23 CN claimed
CN-107849488-B Compound with muguet odor 弗门尼舍有限公司 2021-04-13 CN claimed
EP-3571274-B1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH & CIE (CH) 2020-11-25 EP claimed
EP-3571273-B1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH & CIE (CH) 2020-09-23 EP claimed
US-10597605-B2 Composition having a muguet odor FIRMENICH SA (CH) 2020-03-24 US claimed
US-20190276769-A1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH SA (CH) 2019-09-12 US claimed
CN-110225964-A Composition with muguet odour 弗门尼舍有限公司 2019-09-10 CN claimed
CN-110177861-A Composition with muguet odour 弗门尼舍有限公司 2019-08-27 CN claimed
US-20190249111-A1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH SA (CH) 2019-08-15 US claimed
EP-3322786-B1 COMPOUND HAVING A MUGUET ODOR FIRMENICH & CIE (CH) 2019-04-24 EP claimed
WO-2018134221-A1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH SA (CH) 2018-07-26 WO claimed
WO-2018134220-A1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH SA (CH) 2018-07-26 WO claimed
EP-3947334-B1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2025-10-29 EP disclosed
CN-120091758-A Arthropod control composition 弗门尼舍有限公司 2025-06-03 CN disclosed
CN-119789844-A Fragrance composition containing 2, 3-butanediol and/or 1, 3-butanediol 弗门尼舍有限公司 2025-04-08 CN disclosed
CN-119486703-A Fragrance composition with lasting fragrance appearance 弗门尼舍有限公司 2025-02-18 CN disclosed
CN-119403908-A Method for enhancing psychological performance and composition for use in the method 弗门尼舍有限公司 2025-02-07 CN disclosed
US-12195698-B2 Fragrance compound providing lily of the valley fragrance characteristics, and fragranced compositions comprising the same GIVAUDAN SA (CH) 2025-01-14 US disclosed
CN-111050856-B Methods for identifying positive allosteric modulators of odorant receptors 弗门尼舍有限公司 2024-12-31 CN disclosed
EP-4447678-A1 ARTHROPOD CONTROL COMPOSITIONS Firmenich SA (CH) 2024-10-23 EP disclosed
CN-118555909-A Arthropod control composition 弗门尼舍有限公司 2024-08-27 CN disclosed
CN-116768708-A Composition with muguet smell 弗门尼舍有限公司 2023-09-19 CN disclosed
CN-110177861-B Composition with muguet smell 弗门尼舍有限公司 2023-07-28 CN disclosed
WO-2023139051-A1 ARTHROPOD CONTROL COMPOSITIONS FIRMENICH SA (CH) 2023-07-27 WO disclosed
CN-110225964-B Composition with muguet smell 弗门尼舍有限公司 2023-05-23 CN disclosed
US-20220186140-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2022-06-16 US disclosed
EP-3947334-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan SA (CH) 2022-02-09 EP disclosed
EP-3853328-A2 USE OF VOLATILE COMPOUNDS TO MODULATE THE PERCEPTION OF FLORAL MUGUET Firmenich SA (CH) 2021-07-28 EP disclosed
CN-107849488-B Compound with muguet odor 弗门尼舍有限公司 2021-04-13 CN disclosed
EP-3571274-B1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH & CIE (CH) 2020-11-25 EP disclosed
CN-111788172-A Cyclohexenal derivatives as perfuming ingredients 弗门尼舍有限公司 2020-10-16 CN disclosed
WO-2020201052-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2020-10-08 WO disclosed
EP-3571273-B1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH & CIE (CH) 2020-09-23 EP disclosed
WO-2020127325-A2 USE OF VOLATILE COMPOUNDS TO MODULATE THE PERCEPTION OF FLORAL MUGUET FIRMENICH SA (CH) 2020-06-25 WO disclosed
CN-111295438-A Lily of the valley odorant 弗门尼舍有限公司 2020-06-16 CN disclosed
CN-111050856-A Methods of identifying positive allosteric modulators of odorant receptors 弗门尼舍有限公司 2020-04-21 CN disclosed
US-10597605-B2 Composition having a muguet odor FIRMENICH SA (CH) 2020-03-24 US disclosed
US-20190276769-A1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH SA (CH) 2019-09-12 US disclosed
CN-110225964-A Composition with muguet odour 弗门尼舍有限公司 2019-09-10 CN disclosed
CN-110177861-A Composition with muguet odour 弗门尼舍有限公司 2019-08-27 CN disclosed
US-20190249111-A1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH SA (CH) 2019-08-15 US disclosed
WO-2018134221-A1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH SA (CH) 2018-07-26 WO disclosed
WO-2018134221-A1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH SA (CH) 2018-07-26 WO disclosed
WO-2018134220-A1 COMPOSITION HAVING A MUGUET ODOR FIRMENICH SA (CH) 2018-07-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190276769-A1 COMPOSITION HAVING A MUGUET ODOR C5, OPRM1, CRAT ESR1 1765/4885THRA 2861/4885THRB 2949/4885
US-20190249111-A1 COMPOSITION HAVING A MUGUET ODOR OPRM1, PNMT, C5 ESR1 1259/4885THRA 3480/4885THRB 3434/4885
US-20220186140-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS CYP8B1, HRH1, CBR1 ESR1 508/4885THRA 2848/4885THRB 3694/4885
US-12195698-B2 Fragrance compound providing lily of the valley fragrance characteristics, and fragranced compositions comprising the same MDH2, MDH1, TRPV1 ESR1 892/4885THRA 3589/4885THRB 4140/4885
US-10597605-B2 Composition having a muguet odor C5, OPRM1, CRAT ESR1 1765/4885THRA 2861/4885THRB 2949/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.