SCHEMBL14766979

SCHEMBL14766979

CCOc1ccc(-c2ccc(C3CCC(OCc4ccc(OCC)c(F)c4)CC3)c(F)c2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 8/20 0.41
PPARD Q03181 7/20 0.41
NAAA Q02083 3/20 0.39
PPARA Q07869 2/20 0.38
PPARG P37231 1/20 0.38
FFAR4 Q5NUL3 2/20 0.36
DRD4 P21917 2/20 0.35
SIGMAR1 Q99720 2/20 0.35
HTR6 P50406 1/20 0.35
TMEM97 Q5BJF2 1/20 0.35
KDM1A O60341 2/20 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
SCHEMBL14766989 0.94 NAAA (0.37) FFAR1PPARDNAAAPPARAPPARG
SCHEMBL14766550 0.94 PPARD (0.41) FFAR1PPARDNAAAPPARAPPARG
SCHEMBL12718834 0.94 NAAA (0.42) FFAR1PPARDNAAAPPARAPPARG
SCHEMBL12740329 0.93 NAAA (0.40) FFAR1PPARDNAAAFFAR4DRD4
SCHEMBL12740335 0.92 NAAA (0.39) FFAR1PPARDNAAAFFAR4DRD4
SCHEMBL12740336 0.92 SIGMAR1 (0.43) NAAAFFAR4DRD4SIGMAR1HTR6
SCHEMBL14766867 0.92 GYS1 (0.38) FFAR1PPARDNAAAPPARAPPARG
SCHEMBL14766846 0.91 NAAA (0.38) FFAR1PPARDNAAAPPARAFFAR4
SCHEMBL12740330 0.91 NAAA (0.39) FFAR1PPARDNAAAFFAR4DRD4
SCHEMBL14766567 0.91 PPARD (0.39) FFAR1PPARDNAAAPPARAPPARG

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