SCHEMBL14765726

SCHEMBL14765726

CCOc1ccc(-c2ccc(CCC3CCC(c4ccc(OCC)c(F)c4)CC3)c(F)c2F)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 2/20 0.40
▸ FFAR4 Q5NUL3 5/20 0.37
▸ NAAA Q02083 1/20 0.36
▸ FPR2 P25090 2/20 0.32
▸ FFAR1 O14842 3/20 0.32
▸ PPARD Q03181 2/20 0.32
▸ DGAT1 O75907 1/20 0.31
▸ DHODH Q02127 1/20 0.31
▸ RET P07949 1/20 0.31
▸ CACNA2D1 P54289 1/20 0.31
▸ SLC5A1 P13866 1/20 0.31
▸ SLC5A2 P31639 1/20 0.31
▸ GRIN1 Q05586 1/20 0.30
▸ GRIN2B Q13224 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
SCHEMBL14765984 0.94 KDM1A (0.38) KDM1AFFAR4NAAAFFAR1
SCHEMBL13586545 0.94 KDM1A (0.39) KDM1AFFAR4NAAAFPR2PPARD
SCHEMBL12735142 0.92 KDM1A (0.40) KDM1AFFAR4NAAAFPR2RET
SCHEMBL14765731 0.92 FFAR4 (0.34) KDM1AFFAR4NAAA
SCHEMBL12735126 0.91 KDM1A (0.39) KDM1AFFAR4NAAAFPR2RET
SCHEMBL12735128 0.91 KDM1A (0.39) KDM1AFFAR4NAAAFPR2RET
SCHEMBL12735140 0.91 KDM1A (0.39) KDM1AFFAR4NAAAFPR2RET
SCHEMBL14765936 0.91 FFAR4 (0.38) KDM1AFFAR4PPARD
SCHEMBL14765930 0.91 FFAR4 (0.33) KDM1AFFAR4NAAA
SCHEMBL14765940 0.89 FFAR4 (0.37) KDM1AFFAR4FPR2PPARD

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
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