SCHEMBL14767004

SCHEMBL14767004

C=CCOc1ccc(OCC2CCC(c3ccc(C4CCC(OCC)CC4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 15/20 0.36
PPARD Q03181 8/20 0.36
PDE4D Q08499 1/20 0.35
ACACB O00763 1/20 0.33
PPARA Q07869 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33

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
SCHEMBL14767048 0.96 FFAR1 (0.38) FFAR1PPARDPPARAHTR2CHTR2B
SCHEMBL14765777 0.95 PDE4D (0.35) FFAR1PPARDPDE4DHTR2CHTR2B
SCHEMBL14767211 0.90 FFAR1 (0.35) FFAR1PPARDACACBPPARA
SCHEMBL14766712 0.90 FFAR1 (0.40) FFAR1PPARDACACBPPARA
SCHEMBL14766708 0.89 FFAR1 (0.38) FFAR1PPARDACACBPPARA
SCHEMBL12740690 0.89 SCN9A (0.41) FFAR1PPARDPDE4DPPARAHTR2C
SCHEMBL14765836 0.89 HTR2C (0.38) PDE4DHTR2CHTR2B
SCHEMBL14767050 0.89 HTR2C (0.38) PDE4DHTR2CHTR2B
SCHEMBL14765975 0.89 KDM1A (0.35) PDE4DHTR2CHTR2B
SCHEMBL14766700 0.88 FFAR1 (0.42) FFAR1PPARDPPARA

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