SCHEMBL14766237

SCHEMBL14766237

C=CCCOc1ccc(-c2ccc(OCc3ccc(C4CCC(OCCCC)CC4)c(F)c3F)cc2)cc1F

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 2/20 0.35
▸ FFAR1 O14842 2/20 0.33
▸ PPARD Q03181 2/20 0.33
▸ RARA P10276 1/20 0.33
▸ RARB P10826 1/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.32
▸ GABRA1 P14867 1/20 0.32
▸ GABRB2 P47870 1/20 0.32
▸ SCN9A Q15858 1/20 0.32
▸ CNR2 P34972 2/20 0.32
▸ S1PR1 P21453 1/20 0.31
▸ NR1H4 Q96RI1 1/20 0.30
▸ CNR1 P21554 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
SCHEMBL14766138 0.97 NAAA (0.35) NAAAFFAR1PPARDRARARARB
SCHEMBL14766282 0.95 NAAA (0.37) NAAAFFAR1PPARDFFAR4HRH3
SCHEMBL14766399 0.93 NAAA (0.39) NAAAFFAR1PPARDRARARARB
SCHEMBL14766212 0.91 NAAA (0.42) NAAAFFAR1PPARDRARARARB
SCHEMBL14765990 0.91 NAAA (0.38) NAAAFFAR1PPARDRARARARB
SCHEMBL14765943 0.89 S1PR1 (0.37) NAAARARARARBFFAR4HRH3
SCHEMBL14766068 0.89 FFAR4 (0.35) FFAR4GABRA1GABRB2CNR2CNR1
SCHEMBL14766738 0.89 FFAR4 (0.35) FFAR4GABRA1GABRB2CNR2CNR1
SCHEMBL14766066 0.88 NAAA (0.38) NAAAFFAR1PPARDRARARARB
SCHEMBL12736949 0.88 FFAR1 (0.34) NAAAFFAR1PPARDFFAR4HRH3

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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