SCHEMBL8543036

SCHEMBL8543036

Cc1cc2cc(/C=C/C(=O)O)ccc2[nH]1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP26A1 O43174 2/20 0.57
▸ CYP26B1 Q9NR63 2/20 0.57
▸ MAOB P27338 3/20 0.56
▸ KDM4E B2RXH2 7/20 0.51
▸ ALDH1A1 P00352 6/20 0.51
▸ MAPT P10636 4/20 0.51
▸ HSD17B10 Q99714 3/20 0.51
▸ HPGD P15428 3/20 0.51
▸ CA12 O43570 3/20 0.51
▸ CA1 P00915 3/20 0.51
▸ CA2 P00918 3/20 0.51
▸ CA3 P07451 3/20 0.51
▸ CA4 P22748 3/20 0.51
▸ CA6 P23280 3/20 0.51
▸ CA5A P35218 3/20 0.51
▸ CA7 P43166 3/20 0.51
▸ CA9 Q16790 3/20 0.51
▸ CA14 Q9ULX7 3/20 0.51
▸ CA5B Q9Y2D0 3/20 0.51
▸ POLB P06746 2/20 0.51

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
SCHEMBL8543042 1.00 CYP26A1 (0.57) CYP26A1CYP26B1MAOBKDM4EALDH1A1
SCHEMBL8545402 0.88 KDM4E (0.51) CYP26A1CYP26B1MAOBKDM4EALDH1A1
SCHEMBL8545404 0.88 KDM4E (0.51) CYP26A1CYP26B1MAOBKDM4EALDH1A1
SCHEMBL6071061 0.84 TTR (0.57) MAOBKDM4EALDH1A1MAPTHPGD
SCHEMBL6071058 0.84 TTR (0.57) MAOBKDM4EALDH1A1MAPTHPGD
SCHEMBL34460082 0.80 CYP26A1 (0.64) CYP26A1CYP26B1KDM4EALDH1A1MAPT
SCHEMBL27254464 0.80 CYP26A1 (0.51) CYP26A1CYP26B1KDM4EALDH1A1MAPT
SCHEMBL34460073 0.77 CYP26B1 (0.73) CYP26A1CYP26B1KDM4EALDH1A1MAPT
SCHEMBL4074346 0.76 CYP2A6 (0.53) MAOBKDM4EALDH1A1MAPTHPGD
SCHEMBL889007 0.76 TDP1 (0.47) CYP26A1CYP26B1KDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0715627-B1 INDOLE DERIVATIVES AS THROMBOXANE A2 ANTAGONISTS PFIZER LTD (GB) 1998-09-09 — — EP disclosed
US-5744488-A 1-CARBOXYALKYL-3-ALKYL OR PHENYL-5-ORGANOSULFONAMIDE OR -AMIDE INDOLES; ATHERSCLEROSIS; ANGINA; PREVENTING ANGIOPLASTY OCCULSION; THROMBOXANE SYNTHETASE INHIBITORS PFIZER INC. (US) 1998-04-28 — — US disclosed
EP-0715627-A1 INDOLE DERIVATIVES AS THROMBOXANE A2 ANTAGONISTS Pfizer Limited (GB) 1996-06-12 — — EP disclosed
WO-1995006046-A1 INDOLE DERIVATIVES AS THROMBOXANE A2 ANTAGONISTS PFIZER LIMITED (GB) 1995-03-02 — — WO disclosed
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