SCHEMBL19703000

SCHEMBL19703000

C/C=C/C1CCC(c2ccc(-c3ccc(-c4ccc(CC)cc4)c(F)c3)cc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.38
CYP2C9 P11712 2/20 0.38
APP P05067 2/20 0.38
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
FASN P49327 1/20 0.33
FFAR4 Q5NUL3 1/20 0.32
GRM2 Q14416 2/20 0.31
HTR2A P28223 1/20 0.31
CHKA P35790 1/20 0.31
RARB P10826 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 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
SCHEMBL19702997 0.91 CYP3A4 (0.36) CYP3A4CYP2C9APPCYP2D6CYP2C19
SCHEMBL19703001 0.89 SPHK1 (0.42) CYP3A4CYP2C9FFAR4RARB
SCHEMBL19702998 0.88 SPHK1 (0.46) FFAR4RARB
SCHEMBL19702996 0.87 CYP3A4 (0.38) CYP3A4CYP2C9APPCYP2D6CYP2C19
SCHEMBL19702995 0.87 CYP3A4 (0.40) CYP3A4CYP2C9APPCYP2D6CYP2C19
SCHEMBL29760205 0.86 SPHK1 (0.37)
SCHEMBL25858133 0.86 SPHK1 (0.37)
SCHEMBL8727708 0.84 CYP3A4 (0.36) CYP3A4CYP2C9APPCYP2D6CYP2C19
SCHEMBL8727704 0.84 CYP3A4 (0.36) CYP3A4CYP2C9APPCYP2D6CYP2C19
SCHEMBL8727711 0.84 CYP3A4 (0.36) CYP3A4CYP2C9APPCYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10344211-B2 Liquid crystal composition and liquid crystal display element using same DIC CORPORATION (JP) 2019-07-09 US disclosed
US-20170355906-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC CORPORATION (JP) 2017-12-14 US disclosed
US-20170355906-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC CORPORATION (JP) 2017-12-14 US disclosed