SCHEMBL13586240

SCHEMBL13586240

CCOc1ccc(/C=C/C2CCC(c3ccc(-c4ccc(C(C)O)cc4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 2/20 0.31
▸ PTGS1 P23219 1/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ ALOX5AP P20292 1/20 0.31
▸ FEN1 P39748 1/20 0.31

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
SCHEMBL13586074 1.00 FPR2 (0.31) FPR2PTGS1PTGS2ALOX5APFEN1
SCHEMBL12822713 0.92 HTR2C (0.30) —
SCHEMBL12718083 0.92 HTR2C (0.30) —
SCHEMBL12716180 0.91 FAAH (0.30) —
SCHEMBL12822536 0.91 FAAH (0.30) —
SCHEMBL12821107 0.90 — —
SCHEMBL12823178 0.90 — —
SCHEMBL12823250 0.89 FPR2 (0.36) FPR2PTGS1PTGS2ALOX5APFEN1
SCHEMBL12739170 0.89 FPR2 (0.32) FPR2ALOX5APFEN1
SCHEMBL12734231 0.89 FPR2 (0.32) FPR2ALOX5APFEN1

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
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 — — WO disclosed
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