SCHEMBL2575705

SCHEMBL2575705

C=CC/C=C/CCC(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.59
PPARG P37231 8/20 0.59
CYP19A1 P11511 6/20 0.59
MAPT P10636 5/20 0.59
FFAR1 O14842 5/20 0.59
OXER1 Q8TDS5 4/20 0.59
RXRA P19793 2/20 0.59
ABCC4 O15439 1/20 0.46
F7 P08709 7/20 0.45
F3 P13726 7/20 0.45
PPARD Q03181 6/20 0.45
PPARA Q07869 6/20 0.45
PTGS1 P23219 4/20 0.45
KMT2A Q03164 3/20 0.45
ADORA3 P0DMS8 1/20 0.45
L3MBTL1 Q9Y468 3/20 0.44
KDM4E B2RXH2 3/20 0.44
LMNA P02545 3/20 0.44
CYP3A4 P08684 3/20 0.44
HPGD P15428 3/20 0.44

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
SCHEMBL2575707 1.00 ALDH1A1 (0.59) ALDH1A1PPARGCYP19A1MAPTFFAR1
SCHEMBL8017585 1.00 ALDH1A1 (0.59) ALDH1A1PPARGCYP19A1MAPTFFAR1
SCHEMBL27948496 0.98 ALDH1A1 (0.63) ALDH1A1PPARGCYP19A1MAPTFFAR1
SCHEMBL20528003 0.98 ALDH1A1 (0.63) ALDH1A1PPARGCYP19A1MAPTFFAR1
SCHEMBL14317851 0.98 ALDH1A1 (0.63) ALDH1A1PPARGCYP19A1MAPTFFAR1
SCHEMBL29574065 0.86 ALDH1A1 (0.61) ALDH1A1PPARGCYP19A1MAPTFFAR1
SCHEMBL28742696 0.85 ALDH1A1 (0.66) ALDH1A1PPARGCYP19A1MAPTFFAR1
SCHEMBL10823290 0.83 MAPT (0.54) ALDH1A1PPARGCYP19A1MAPTFFAR1
SCHEMBL10823289 0.83 MAPT (0.54) ALDH1A1PPARGCYP19A1MAPTFFAR1
SCHEMBL15153051 0.83 MAPT (0.67) ALDH1A1PPARGCYP19A1MAPTFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240050337-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2024-02-15 US claimed
EP-4096618-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS Symrise AG (DE) 2022-12-07 EP claimed
WO-2022122143-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2022-06-16 WO claimed
US-10336966-B2 Fragrance compositions and uses thereof THE PROCTER & GAMBLE COMPANY (US) 2019-07-02 US claimed
US-20190155975-A9 Antiperspirant and Deodorant Compositions Comprising Malodor Reduction Compositions THE PROCTER & GAMBLE COMPANY 2019-05-23 US claimed
US-10113140-B2 Freshening compositions and devices comprising same THE PROCTER & GAMBLE COMPANY (US) 2018-10-30 US claimed
WO-2018145219-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND TREATING ADDICTIONS BY MEANS OF AVERSIVE COUNTERCONDITIONING SERANI MOSTAZAL JORGE (CL) 2018-08-16 WO claimed
US-20180004875-A1 Antiperspirant and Deodorant Compositions Comprising Malodor Reduction Compositions THE PROCTER & GAMBLE COMPANY 2018-01-04 US claimed
US-20170333591-A9 ABSORBENT ARTICLE COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY 2017-11-23 US claimed
US-9814661-B2 Fragrance compositions THE PROCTER & GAMBLE COMPANY (US) 2017-11-14 US claimed
WO-2016049396-A1 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO claimed
US-20160090555-A1 CLEANING AND/OR TREATMENT COMPOSITIONS COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY 2016-03-31 US claimed
WO-2016049397-A1 FRESHENING COMPOSITIONS AND DEVICES COMPRISING SAME THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO claimed
WO-2016049394-A1 CLEANING AND/OR TREATMENT COMPOSITIONS COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO claimed
EP-2961374-A1 FRAGRANCE COMPOSITIONS The Procter & Gamble Company (US) 2016-01-06 EP claimed
WO-2015089246-A1 FRAGRANCE COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2015-06-18 WO claimed
US-20150164764-A1 Fragrance Compositions THE PROCTER & GAMBLE COMPANY 2015-06-18 US claimed
EP-0773209-B1 Unsaturated esters GIVAUDAN ROURE INT (CH) 2000-01-26 EP claimed
US-5837671-A ETHYL OCTADIENOATE FOR TASTE AND ODOR GIVAUDAN-ROURE (INTERNATIONAL) SA (CH) 1998-11-17 US claimed
EP-0773209-A1 Unsaturated esters GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1997-05-14 EP claimed

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

For each of this compound's patents that has machine-readable text (3 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-20150164764-A1 Fragrance Compositions OGG1, ALKBH5, MYB ALDH1A1 1367/4885PPARG 743/4885CYP19A1 439/4885
US-10336966-B2 Fragrance compositions and uses thereof CUTA, DPM1, PLIN5 ALDH1A1 1263/4885PPARG 1576/4885CYP19A1 222/4885
US-20240050337-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS OR10J3, OR51E2, MAL2 ALDH1A1 27/4885PPARG 3888/4885CYP19A1 935/4885

“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.