SCHEMBL21903085

SCHEMBL21903085

CC/C=C\CCCC(=O)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.62
CYP19A1 P11511 5/20 0.62
PPARG P37231 5/20 0.62
F7 P08709 3/20 0.62
F3 P13726 3/20 0.62
OXER1 Q8TDS5 3/20 0.62
KMT2A Q03164 3/20 0.62
PPARD Q03181 3/20 0.62
PPARA Q07869 3/20 0.62
PTGS1 P23219 2/20 0.62
ADORA3 P0DMS8 2/20 0.62
RXRA P19793 2/20 0.62
MAPT P10636 4/20 0.53
FFAR1 O14842 2/20 0.53
NR1I2 O75469 2/20 0.53
PTGS2 P35354 2/20 0.53
KDM4E B2RXH2 2/20 0.53
MEN1 O00255 2/20 0.53
LMNA P02545 2/20 0.53
CYP3A4 P08684 2/20 0.53

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
SCHEMBL21903084 1.00 ALDH1A1 (0.62) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL278197 0.94 ALDH1A1 (0.72) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL1655436 0.92 F7 (0.65) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL29033609 0.92 F7 (0.65) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL3509409 0.83 TOP1 (0.69) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL583941 0.82 PPARG (0.88) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL583940 0.82 PPARG (0.88) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL583942 0.82 PPARG (0.88) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL29367490 0.82 PPARG (0.88) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL20971537 0.80 PPARG (0.73) ALDH1A1CYP19A1PPARGF7F3

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230301329-A1 COMPOSITIONS COMPRISING COOLNESS-REGULATING AGENT, AND METHOD OF USE THEREOF EPC NATURAL PRODUCTS CO., LTD. (CN) 2023-09-28 US claimed
US-11751593-B2 Sweetener and flavor compositions, methods of making and methods of use thereof EPC Natural Products Co., Ltd (CN) 2023-09-12 US claimed
US-20210386104-A1 WATER SOLUBLE FLAVOR COMPOSITIONS, METHODS OF MAKING AND METHODS OF USE THEREOF EPC Natural Products Co., Ltd (CN) 2021-12-16 US claimed
CN-113271793-A Water-soluble flavor composition, preparation method and application method thereof 伊比西(北京)植物药物技术有限公司 2021-08-17 CN claimed
US-20200138071-A1 SWEETENER AND FLAVOR COMPOSITIONS, METHODS OF MAKING AND METHODS OF USE THEREOF EPC Natural Products Co., Ltd (CN) 2020-05-07 US claimed
US-20230301329-A1 COMPOSITIONS COMPRISING COOLNESS-REGULATING AGENT, AND METHOD OF USE THEREOF EPC NATURAL PRODUCTS CO., LTD. (CN) 2023-09-28 US disclosed
US-11751593-B2 Sweetener and flavor compositions, methods of making and methods of use thereof EPC Natural Products Co., Ltd (CN) 2023-09-12 US disclosed
US-20210386104-A1 WATER SOLUBLE FLAVOR COMPOSITIONS, METHODS OF MAKING AND METHODS OF USE THEREOF EPC Natural Products Co., Ltd (CN) 2021-12-16 US disclosed
CN-113271793-A Water-soluble flavor composition, preparation method and application method thereof 伊比西(北京)植物药物技术有限公司 2021-08-17 CN disclosed
US-20200138071-A1 SWEETENER AND FLAVOR COMPOSITIONS, METHODS OF MAKING AND METHODS OF USE THEREOF EPC Natural Products Co., Ltd (CN) 2020-05-07 US disclosed