SCHEMBL14766700

SCHEMBL14766700

CCOc1ccc(OCC2CCC(c3ccc(C4CCC(OCC)CC4)c(F)c3F)CC2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 15/20 0.42
PPARD Q03181 8/20 0.42
KDM1A O60341 2/20 0.38
PPARA Q07869 1/20 0.38
PARP15 Q460N3 1/20 0.37
PARP10 Q53GL7 1/20 0.37

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
SCHEMBL14766712 0.96 FFAR1 (0.40) FFAR1PPARDKDM1APPARA
SCHEMBL14767051 0.92 FFAR1 (0.39) FFAR1PPARDKDM1APPARA
SCHEMBL13586387 0.91 FFAR1 (0.42) FFAR1PPARDKDM1APPARAPARP15
SCHEMBL12740644 0.91 FFAR1 (0.43) FFAR1PPARDKDM1APPARAPARP15
SCHEMBL14766687 0.90 FFAR1 (0.40) FFAR1PPARDPPARAPARP15PARP10
SCHEMBL14766019 0.90 GPR119 (0.39) FFAR1PPARDPARP15PARP10
SCHEMBL12740651 0.90 FFAR1 (0.42) FFAR1PPARDKDM1APPARAPARP15
SCHEMBL14767048 0.90 FFAR1 (0.38) FFAR1PPARDPPARA
SCHEMBL14767056 0.89 FFAR1 (0.39) FFAR1PPARDPPARAPARP15PARP10
SCHEMBL14766708 0.89 FFAR1 (0.38) FFAR1PPARDPPARAPARP15PARP10

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