SCHEMBL6473377

SCHEMBL6473377

COc1ccc(C2CC2(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.47
OPRL1 P41146 1/20 0.47
MAPT P10636 7/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
KDM4E B2RXH2 2/20 0.45
GAA P10253 3/20 0.44
NPSR1 Q6W5P4 3/20 0.44
ATM Q13315 2/20 0.44
NPC1 O15118 2/20 0.44
CA4 P22748 1/20 0.43
LTA4H P09960 1/20 0.42
MAOB P27338 4/20 0.42
MAOA P21397 4/20 0.42
MAPK1 P28482 1/20 0.42
TP53 P04637 1/20 0.41
PTGS2 P35354 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL5998298 0.81 KDM1A (0.57) MAOBMAOAKDM1A
SCHEMBL15778838 0.80 KDM1A (0.69) OPRM1OPRL1MAPTALDH1A1HPGD
SCHEMBL28244237 0.77 OPRM1 (0.45) OPRM1OPRL1MAPTALDH1A1HPGD
SCHEMBL17591832 0.74 ACP3 (0.43) OPRM1OPRL1MAPTALDH1A1HPGD
SCHEMBL6317162 0.74 MAPT (0.42) OPRM1OPRL1MAPTALDH1A1HPGD
SCHEMBL13888944 0.74 MAOB (0.50) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL12188964 0.74 MAOB (0.50) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL6320891 0.73 ITGB3 (0.51) OPRM1OPRL1MAPTALDH1A1HPGD
SCHEMBL1975325 0.73 PLK4 (0.55) ALDH1A1KDM4E
SCHEMBL1973991 0.73 PLK4 (0.55) ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005007659-A2 DIKETIMINATO CU(I) AND CO(I) CARBENE CATALYSTS, AND CYCLOPROPANATION METHODS USING THEM GEORGETOWN UNIVERSITY (US) 2005-01-27 WO disclosed