SCHEMBL14767217

SCHEMBL14767217

CCCCOc1ccc(-c2ccc(C3CCC(C(=O)Oc4ccc(OCCCC)c(F)c4F)CC3)c(F)c2F)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
FFAR4 Q5NUL3 3/20 0.36
RARB P10826 5/20 0.36
RARA P10276 1/20 0.36
FFAR1 O14842 1/20 0.36
SCN9A Q15858 1/20 0.36
S1PR1 P21453 5/20 0.34
S1PR5 Q9H228 4/20 0.34
PPARD Q03181 1/20 0.34
S1PR3 Q99500 3/20 0.34
FAAH O00519 1/20 0.34

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
SCHEMBL14766008 1.00 RAB9A (0.37) RAB9ANPC1ALDH1A1SMN1; SMN2FFAR4
SCHEMBL14767120 0.98 ACACB (0.37) RAB9ANPC1ALDH1A1SMN1; SMN2FFAR4
SCHEMBL14765946 0.98 ACACB (0.37) RAB9ANPC1ALDH1A1SMN1; SMN2FFAR4
SCHEMBL14766909 0.97 FFAR4 (0.37) RAB9ANPC1ALDH1A1SMN1; SMN2FFAR4
SCHEMBL14766275 0.97 FFAR4 (0.37) RAB9ANPC1ALDH1A1SMN1; SMN2FFAR4
SCHEMBL14767253 0.94 ALDH1A1 (0.35) RAB9ANPC1ALDH1A1SMN1; SMN2FFAR4
SCHEMBL14766178 0.94 ALDH1A1 (0.35) RAB9ANPC1ALDH1A1SMN1; SMN2FFAR4
SCHEMBL12742269 0.93 PPARD (0.35) FFAR4RARBSCN9APPARD
SCHEMBL12737293 0.93 PPARD (0.35) FFAR4RARBSCN9APPARD
SCHEMBL14767075 0.93 SCN9A (0.34) RAB9ANPC1ALDH1A1SMN1; SMN2FFAR4

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