SCHEMBL14219976

SCHEMBL14219976

C[C@@H](CC1CCC(CCc2ccc(-c3cc(F)c(Cl)c(F)c3)cc2)CC1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.34
FFAR4 Q5NUL3 1/20 0.33
CHRM4 P08173 2/20 0.33
GPR84 Q9NQS5 1/20 0.33
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
SLC6A3 Q01959 2/20 0.32
SLC6A4 P31645 1/20 0.32

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
SCHEMBL14219989 0.91 ANPEP (0.34) MAOBFFAR4GPR84
SCHEMBL14219343 0.90 PRCP (0.37) MAOBFFAR4CHRM4ADRB1ADRB3
SCHEMBL14219977 0.90 PRCP (0.37) MAOBFFAR4CHRM4ADRB1ADRB3
SCHEMBL14219350 0.89 PDPK1 (0.35) FFAR4GPR84
SCHEMBL14219339 0.87 MAOB (0.33) MAOBGPR84
SCHEMBL14219436 0.86 HTR2A (0.32) MAOBSLC6A3SLC6A4
SCHEMBL14219443 0.86 HTR2A (0.32) MAOBSLC6A3SLC6A4
SCHEMBL14219993 0.86 KDM4E (0.34) MAOBGPR84
SCHEMBL14219489 0.86 POLB (0.43) MAOBSLC6A3SLC6A4
SCHEMBL14219348 0.86 POLB (0.43) MAOBSLC6A3SLC6A4

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