SCHEMBL6991948

SCHEMBL6991948

[CH](Cc1cccc(OCc2ccccc2)c1)c1cccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.51
MAOA P21397 1/20 0.51
ALOX5 P09917 1/20 0.50
BCHE P06276 4/20 0.49
CYP4F2 P78329 1/20 0.49
CYP4A11 Q02928 1/20 0.49
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
LCK P06239 1/20 0.46
NR4A2 P43354 1/20 0.44
CCNB2 O95067 1/20 0.44
CDK1 P06493 1/20 0.44
CDK4 P11802 1/20 0.44
CCNB1 P14635 1/20 0.44
CCND1 P24385 1/20 0.44
CCNB3 Q8WWL7 1/20 0.44
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
PKM P14618 2/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL5620883 0.83 MAOB (0.54) MAOBMAOAALOX5BCHECYP4F2
SCHEMBL1826161 0.80 MAOB (0.43) MAOBKDM4E
SCHEMBL8710346 0.79 MAOB (0.69) MAOBMAOABCHECYP4F2CYP4A11
SCHEMBL8674540 0.78 MAOB (0.71) MAOBMAOABCHECYP4F2CYP4A11
SCHEMBL13859154 0.76 MAOB (0.64) MAOBMAOAALOX5BCHECYP4F2
SCHEMBL1009475 0.76 MAOB (0.68) MAOBMAOAALOX5BCHECYP4F2
SCHEMBL1351689 0.75 BCHE (0.64) MAOBMAOAALOX5BCHECYP4F2
SCHEMBL6190936 0.75 MAPT (0.44) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL7489763 0.74 MAOB (0.62) MAOBMAOAALOX5BCHECYP4F2
SCHEMBL9434797 0.74 BCHE (0.58) MAOBMAOAALOX5BCHECYP4F2

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-1322617-A1 COMPOUNDS AND METHODS FOR MODULATION OF ESTROGEN RECEPTORS SIGNAL PHARMACEUTICALS, INC. (US) 2003-07-02 EP disclosed
WO-2002024653-A1 COMPOUNDS AND METHODS FOR MODULATION OF ESTROGEN RECEPTORS SIGNAL PHARMACEUTICALS, INC. (US) 2002-03-28 WO disclosed