SCHEMBL20165797

SCHEMBL20165797

CC(C)Cc1ccc2c(c1)OCC(=O)CO2

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.53
SLC6A4 P31645 3/20 0.53
SLC6A2 P23975 2/20 0.53
SLC6A3 Q01959 2/20 0.53
CYP2D6 P10635 2/20 0.50
NPSR1 Q6W5P4 1/20 0.46
CYP3A4 P08684 2/20 0.45
POLB P06746 1/20 0.44
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
ATM Q13315 1/20 0.42
TRPV1 Q8NER1 1/20 0.41
CMA1 P23946 1/20 0.41

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
SCHEMBL5381801 0.86 TAAR1 (0.49) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL5386460 0.84 TAAR1 (0.46) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL180328 0.84 TAAR1 (0.43) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL5377511 0.83 TAAR1 (0.47) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL5018909 0.82 TAAR1 (0.59) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL104467 0.82 TAAR1 (0.74) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL5372792 0.81 GRIN2D (0.43) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL6567451 0.81 PARP1 (0.57) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL12775573 0.79 TAAR1 (0.56) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL14518821 0.79 MAOA (0.47) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026104604-A1 SOLID FRAGRANCE COMPOSITION FIRMENICH SA (CH) 2026-05-21 WO claimed
EP-4514477-A1 FRAGRANCE COMPOSITIONS HAVING LONG-LASTING TRAIL PERFORMANCE Firmenich SA (CH) 2025-03-05 EP claimed
WO-2023247599-A1 FRAGRANCE COMPOSITIONS HAVING LONG-LASTING TRAIL PERFORMANCE FIRMENICH SA (CH) 2023-12-28 WO claimed
WO-2026104604-A1 SOLID FRAGRANCE COMPOSITION FIRMENICH SA (CH) 2026-05-21 WO disclosed
US-12497577-B2 Method of countering malodour in a washing machine comprising the addition of a fragrance precursor GIVAUDAN SA (CH) 2025-12-16 US disclosed
EP-4514477-A1 FRAGRANCE COMPOSITIONS HAVING LONG-LASTING TRAIL PERFORMANCE Firmenich SA (CH) 2025-03-05 EP disclosed
EP-4218837-B1 VOLATILE COMPOSITIONS TO LIMIT OR ELIMINATE PERCEPTION OF FECAL MALODOUR FIRMENICH & CIE (CH) 2024-11-27 EP disclosed
US-20240309296-A1 METHOD OF COUNTERING MALODOUR IN A WASHING MACHINE COMPRISING THE ADDITION OF A FRAGRANCE PRECURSOR GIVAUDAN SA (CH) 2024-09-19 US disclosed
US-12024690-B2 Method of countering malodour in a washing machine comprising the addition of a fragrance precursor accord comprising 4-(dodecylthio)-4-methylpentan-2-one GIVAUDAN SA (CH) 2024-07-02 US disclosed
EP-4338761-A1 PERFUMING COMPOSITIONS Firmenich SA (CH) 2024-03-20 EP disclosed
WO-2023247599-A1 FRAGRANCE COMPOSITIONS HAVING LONG-LASTING TRAIL PERFORMANCE FIRMENICH SA (CH) 2023-12-28 WO disclosed
US-10934240-B2 Cyclohexene derivatives as perfuming ingredients FIRMENICH SA (CH) 2021-03-02 US disclosed
WO-2020125922-A1 A METHOD OF COUNTERING MALODOUR IN A WASHING MACHINE COMPRISING THE ADDITION OF A FRAGRANCE PRECURSOR GIVAUDAN SA (CH) 2020-06-25 WO disclosed
US-20200071253-A1 CYCLOHEXENE DERIVATIVES AS PERFUMING INGREDIENTS FIRMENICH SA (CH) 2020-03-05 US disclosed
US-20190343977-A1 USE OF VOLATILE COMPOSITIONS TO LIMIT OR ELIMINATE PERCEPTION OF FECAL MALODOUR FIRMENICH SA (CH) 2019-11-14 US disclosed
EP-3541435-A1 USE OF VOLATILE COMPOSITIONS TO LIMIT OR ELIMINATE PERCEPTION OF FECAL MALODOUR Firmenich SA (CH) 2019-09-25 EP disclosed
EP-3349862-B1 A GREEN, LILY OF THE VALLEY PERFUMING INGREDIENT FIRMENICH & CIE (CH) 2019-09-04 EP disclosed
US-10100267-B1 Green, lily of the valley perfuming ingredient FIRMENICH SA (CH) 2018-10-16 US disclosed
US-20180282660-A1 A GREEN, LILY OF THE VALLEY PERFUMING INGREDIENT FIRMENICH SA (CH) 2018-10-04 US disclosed
WO-2018091686-A1 USE OF VOLATILE COMPOSITIONS TO LIMIT OR ELIMINATE PERCEPTION OF FECAL MALODOUR FIRMENICH SA (CH) 2018-05-24 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 (4 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-10100267-B1 Green, lily of the valley perfuming ingredient CYCS, ACLY, CYC1 TAAR1 1864/4885SLC6A4 3627/4885SLC6A2 4681/4885
US-10934240-B2 Cyclohexene derivatives as perfuming ingredients C5, C1S, C1R TAAR1 1502/4885SLC6A4 1693/4885SLC6A2 3578/4885
US-20200071253-A1 CYCLOHEXENE DERIVATIVES AS PERFUMING INGREDIENTS C5, C1S, C1R TAAR1 1502/4885SLC6A4 1693/4885SLC6A2 3578/4885
US-20180282660-A1 A GREEN, LILY OF THE VALLEY PERFUMING INGREDIENT CYCS, ACLY, CYC1 TAAR1 2040/4885SLC6A4 3241/4885SLC6A2 4505/4885

“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.