SCHEMBL8960692

SCHEMBL8960692

C=CCOc1ccc(-c2ccc(-c3ccc(C4CCC(C5CCC(CCCCC)CC5)CC4)c(F)c3)cc2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.32
HTR2B P41595 2/20 0.32
OPRL1 P41146 3/20 0.31
HTR2A P28223 2/20 0.31
FFAR4 Q5NUL3 1/20 0.31
DGAT1 O75907 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
SCHEMBL8961138 0.99 HTR2C (0.31) HTR2CHTR2BOPRL1HTR2AFFAR4
SCHEMBL8934040 0.97 HTR2C (0.33) HTR2CHTR2BOPRL1HTR2AFFAR4
SCHEMBL8960227 0.94 HTR2C (0.33) HTR2CHTR2BOPRL1HTR2AFFAR4
SCHEMBL8961663 0.92 FFAR4 (0.32) FFAR4
SCHEMBL8961712 0.92 FFAR4 (0.31) FFAR4
SCHEMBL8962834 0.91 HTR2C (0.32) HTR2CHTR2BHTR2A
SCHEMBL8962924 0.91 HTR2C (0.32) HTR2CHTR2BHTR2A
SCHEMBL8963378 0.91 HTR2C (0.32) HTR2CHTR2BHTR2A
SCHEMBL8933980 0.91 HTR2C (0.34) HTR2CHTR2BOPRL1HTR2AFFAR4
SCHEMBL8960881 0.91 OPRL1 (0.33) OPRL1FFAR4DGAT1

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-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed