SCHEMBL14219571

SCHEMBL14219571

CCCc1c(F)cc(C2CCC(CCc3ccc(C[C@H](C)c4ccccc4)cc3)CC2)cc1F

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.32
MAOA P21397 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
POLB P06746 1/20 0.31
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 0.30
OPRK1 P41145 1/20 0.30
OPRL1 P41146 1/20 0.30

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
SCHEMBL14219965 1.00 MAOB (0.32) MAOBMAOASIGMAR1POLBOPRM1
SCHEMBL14219448 0.93 FFAR4 (0.33) SIGMAR1
SCHEMBL14219936 0.93 FFAR4 (0.33) SIGMAR1
SCHEMBL14219933 0.93 MAOB (0.35) MAOBMAOASIGMAR1POLBOPRM1
SCHEMBL14219963 0.93 MAOB (0.35) MAOBMAOASIGMAR1POLBOPRM1
SCHEMBL14219383 0.90 SPHK1 (0.34) SIGMAR1POLB
SCHEMBL14219581 0.88 RORC (0.33) MAOBMAOA
SCHEMBL14219992 0.88 RORC (0.33) MAOBMAOA
SCHEMBL14219938 0.87 POLB (0.38) MAOBPOLB
SCHEMBL14219479 0.87 MAOB (0.34) MAOBSIGMAR1POLB

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
EP-1650285-B1 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEM KK (JP) 2008-04-30 EP disclosed