SCHEMBL14765907

SCHEMBL14765907

CCOc1ccc(C2CCC(CCc3ccc(C4CCC(OCC)CC4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 1/20 0.31
NAAA Q02083 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
SCHEMBL14766388 1.00 HCRTR2 (0.31) HCRTR2NAAAOPRL1
SCHEMBL14922530 0.94 OPRL1 (0.33) OPRL1
SCHEMBL1242547 0.94 OPRL1 (0.33) OPRL1
SCHEMBL1242548 0.94 OPRL1 (0.33) OPRL1
SCHEMBL14922610 0.91 HTR2C (0.33) OPRL1
SCHEMBL14767015 0.91 DAO (0.34) OPRL1
SCHEMBL12717009 0.91 DAO (0.34) OPRL1
SCHEMBL12739661 0.91 OPRL1 (0.31) OPRL1
SCHEMBL12196757 0.91 CTSL (0.34) OPRL1
SCHEMBL12734848 0.91 OPRL1 (0.31) OPRL1

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed