SCHEMBL11267081

SCHEMBL11267081

CC=CCOc1ccc(Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LSS P48449 3/20 0.44
PPARD Q03181 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
APP P05067 1/20 0.40
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
CHRNA7 P36544 1/20 0.39
MAOB P27338 2/20 0.39
AOC3 Q16853 1/20 0.38
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL11267037 1.00 LSS (0.44) LSSPPARDKDM4EALDH1A1APP
SCHEMBL10529954 0.83 LTA4H (0.43) AOC3
SCHEMBL10529963 0.83 LTA4H (0.43) AOC3
SCHEMBL7723533 0.82 LSS (0.39) LSSPPARDKDM4EALDH1A1APP
SCHEMBL7723537 0.82 LSS (0.39) LSSPPARDKDM4EALDH1A1APP
SCHEMBL11802298 0.82 LSS (0.47) LSSPPARDKDM4EALDH1A1APP
SCHEMBL11802292 0.82 LSS (0.47) LSSPPARDKDM4EALDH1A1APP
SCHEMBL15274492 0.81 L3MBTL1 (0.46) DRD2DRD4DRD3AOC3MAPT
SCHEMBL1069709 0.81 LMNA (0.48) KDM4EALDH1A1APPMAPT
SCHEMBL1069708 0.81 LMNA (0.48) KDM4EALDH1A1APPMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0019377-B1 1-HYDROCARBYLOXYPHENYL-1,2-DIPHENYLALKENE DERIVATIVES, THEIR MANUFACTURE AND A PHARMACEUTICAL COMPOSITION CONTAINING THEM IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-08-04 EP disclosed
US-4307111-A ANTIESTROGENS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-12-22 US disclosed
EP-0019377-A1 1-Hydrocarbyloxyphenyl-1,2-diphenylalkene derivatives, their manufacture and a pharmaceutical composition containing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-11-26 EP disclosed