SCHEMBL4446157

SCHEMBL4446157

COc1ccc(C2Cc3c(C)cc(OC)cc3C2c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 2/20 0.44
KDM1A O60341 5/20 0.43
MAOB P27338 4/20 0.43
MAOA P21397 3/20 0.43
EDNRB P24530 1/20 0.42
ALDH1A1 P00352 1/20 0.41
RAB9A P51151 2/20 0.40
MAPT P10636 2/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL13598955 0.80 NQO2 (0.52) EDNRAKDM1AMAOBMAOAEDNRB
SCHEMBL27569651 0.76 EDNRA (0.52) EDNRAKDM1AMAOBMAOAEDNRB
SCHEMBL13599076 0.76 ESR2 (0.41) ALDH1A1
SCHEMBL4420199 0.72 EDNRA (0.48) EDNRAMAOBMAOAEDNRBALDH1A1
SCHEMBL31132281 0.69 KDM1A (0.62) EDNRAKDM1AMAOBMAOAALDH1A1
SCHEMBL27910201 0.69 KDM1A (0.62) EDNRAKDM1AMAOBMAOAALDH1A1
SCHEMBL11824986 0.69 SLC6A9 (0.57) KDM1AMAOBMAOA
SCHEMBL11824979 0.69 SLC6A9 (0.57) KDM1AMAOBMAOA
SCHEMBL11824975 0.69 SLC6A9 (0.57) KDM1AMAOBMAOA
SCHEMBL8946486 0.68 MAPT (0.35) MAOAALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2074102-A1 2-PHENYL INDENE DERIVATIVES USEFUL AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2009-07-01 EP disclosed
WO-2008043567-A1 2-PHENYL INDENE DERIVATIVES USEFUL AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2008-04-17 WO disclosed