SCHEMBL14765714

SCHEMBL14765714

CCCCOc1ccc(-c2ccc(/C=C/C3CCC(c4ccc(OCC)c(F)c4)CC3)c(F)c2F)cc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.37
FFAR4 Q5NUL3 3/20 0.33
FFAR1 O14842 1/20 0.33
RAB9A P51151 1/20 0.32
RARA P10276 1/20 0.32
RARB P10826 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
BRD4 O60885 1/20 0.31
CYP2C9 P11712 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
MGAT2 Q10469 1/20 0.30
FPR2 P25090 1/20 0.30
NAAA Q02083 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
SCHEMBL14765899 0.96 RAB9A (0.33) KDM1AFFAR4FFAR1RAB9ARARA
SCHEMBL14765953 0.95 FPR2 (0.33) KDM1AFFAR4RAB9ARARARARB
SCHEMBL14765696 0.95 KDM1A (0.39) KDM1AFFAR4FFAR1FPR2NAAA
SCHEMBL14765697 0.93 CNR2 (0.31) KDM1AFFAR4
SCHEMBL12716182 0.91 KDM1A (0.38) KDM1AFPR2NAAA
SCHEMBL14765732 0.91 CNR2 (0.31)
SCHEMBL12734290 0.90 KDM1A (0.31) KDM1A
SCHEMBL12734274 0.90 SPHK1 (0.36) KDM1AFFAR4RARB
SCHEMBL12734286 0.89 KDM1A (0.39) KDM1ARAB9AFPR2NAAA
SCHEMBL14765887 0.89 KDM1A (0.34) KDM1AFFAR4

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