SCHEMBL13066972

SCHEMBL13066972

CCCC1CCC(CCc2ccc(-c3ccc(-c4ccc(C(C)O)cc4)c(C(F)F)c3F)cc2)CC1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.33
GPR84 Q9NQS5 1/20 0.32
FFAR4 Q5NUL3 5/20 0.31
MAOA P21397 1/20 0.31
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR7 P34969 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
SCHEMBL13066957 0.88
SCHEMBL13066741 0.85
SCHEMBL12834711 0.85 ACACB (0.36)
SCHEMBL13025992 0.83 RAB9A (0.38) FFAR4
SCHEMBL13026013 0.82 MAOB (0.33) MAOBGPR84MAOA
SCHEMBL13025898 0.82 MAOA (0.31) MAOBGPR84MAOA
SCHEMBL12834173 0.80 MAOB (0.38) MAOBGPR84FFAR4MAOA
SCHEMBL13025726 0.80 FFAR4 (0.41) MAOBGPR84FFAR4MAOA
SCHEMBL13067349 0.79 AKR1C3 (0.30)
SCHEMBL13066967 0.79 VEGFA (0.36)

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
US-7838087-B2 Benzene derivative, liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2010-11-23 US disclosed