SCHEMBL14767149

SCHEMBL14767149

C=CCCOc1ccc(OC(=O)C2CCC(c3ccc(C4CCC(OCCCC)CC4)c(F)c3F)CC2)cc1F

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.37
FAAH O00519 2/20 0.32
HPGD P15428 1/20 0.32
CRBN Q96SW2 1/20 0.32
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
HCRTR2 O43614 1/20 0.31
ACACB O00763 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
SCHEMBL14767239 0.97 SCN9A (0.36) SCN9AFAAHHPGDCRBNTHRA
SCHEMBL14767307 0.95 HPGD (0.34) SCN9AHPGDHCRTR2ACACB
SCHEMBL14767247 0.93 FAAH (0.35) SCN9AFAAHHPGDCRBNACACB
SCHEMBL14766721 0.93 SCN9A (0.39) SCN9AFAAHHPGDCRBNTHRA
SCHEMBL14766197 0.91 SCN9A (0.36) SCN9AHPGDTHRATHRBHCRTR2
SCHEMBL14766016 0.91 SCN9A (0.35) SCN9AFAAHHPGDCRBNHCRTR2
SCHEMBL14766978 0.91 FAAH (0.36) SCN9AFAAHHPGDCRBN
SCHEMBL14766474 0.91 SCN9A (0.36) SCN9AHPGDHCRTR2ACACB
SCHEMBL14767053 0.91 SCN9A (0.36) SCN9AHPGDHCRTR2ACACB
SCHEMBL14767272 0.90 HPGD (0.37) SCN9AFAAHHPGDCRBNHCRTR2

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