SCHEMBL15723201

SCHEMBL15723201

C/C=C/Oc1ccc(OCC2CCC(C3CCC(c4ccc(CCC)cc4)CC3)CC2)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 11/20 0.33
SPHK2 Q9NRA0 7/20 0.30
SGPL1 O95470 1/20 0.30
S1PR1 P21453 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
SCHEMBL17359407 0.88 SPHK1 (0.38) SPHK1SPHK2
SCHEMBL15723202 0.87 SPHK1 (0.43) SPHK1SPHK2
SCHEMBL15723169 0.86 SPHK1 (0.35) SPHK1SPHK2
SCHEMBL15723200 0.86 CYP2C9 (0.41) SGPL1S1PR1
SCHEMBL17359411 0.86 SPHK1 (0.36) SPHK1SPHK2
SCHEMBL15723181 0.86 SPHK1 (0.33) SPHK1
SCHEMBL17357025 0.85 SPHK1 (0.36) SPHK1SPHK2
SCHEMBL17359388 0.85 SPHK1 (0.40) SPHK1SPHK2
SCHEMBL15723199 0.84 CYP2C9 (0.37)
SCHEMBL15723217 0.83 SPHK1 (0.32) SPHK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9193907-B2 Liquid crystal compound having vinyloxy, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-11-24 US disclosed
US-9193907-B2 Liquid crystal compound having vinyloxy, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-11-24 US disclosed
US-20140138582-A1 LIQUID CRYSTAL COMPOUND HAVING VINYLOXY, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-05-22 US disclosed
US-20140138582-A1 LIQUID CRYSTAL COMPOUND HAVING VINYLOXY, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-05-22 US disclosed