SCHEMBL13654119

SCHEMBL13654119

COc1ccc(OCC2CCC(c3ccc(C4CO4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 3/20 0.41
▸ PDE4B Q07343 6/20 0.38
▸ HTR2A P28223 2/20 0.37
▸ HTR2C P28335 2/20 0.37
▸ HTR2B P41595 2/20 0.37
▸ SGPL1 O95470 1/20 0.35
▸ S1PR1 P21453 1/20 0.35
▸ CNR2 P34972 6/20 0.35
▸ CNR1 P21554 1/20 0.34
▸ TRPC6 Q9Y210 1/20 0.33
▸ ALOX5AP P20292 1/20 0.33
▸ FEN1 P39748 1/20 0.33

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
SCHEMBL12836508 0.95 FPR2 (0.39) FPR2PDE4BHTR2AHTR2CHTR2B
SCHEMBL12836047 0.95 FPR2 (0.39) FPR2PDE4BHTR2AHTR2CHTR2B
SCHEMBL13586230 0.92 FPR2 (0.36) FPR2PDE4BHTR2AHTR2CHTR2B
SCHEMBL10303209 0.91 FPR2 (0.41) FPR2PDE4BHTR2AHTR2CHTR2B
SCHEMBL13586359 0.90 CNR2 (0.39) FPR2HTR2AHTR2CHTR2BCNR2
SCHEMBL12822967 0.90 CNR2 (0.39) FPR2HTR2AHTR2CHTR2BCNR2
SCHEMBL12907908 0.88 SLC6A2 (0.35) FPR2HTR2CALOX5APFEN1
SCHEMBL13586282 0.88 CNR2 (0.36) FPR2HTR2AHTR2CHTR2BCNR2
SCHEMBL12821510 0.88 CNR2 (0.36) FPR2HTR2AHTR2CHTR2BCNR2
SCHEMBL10303139 0.87 FPR2 (0.39) FPR2PDE4BHTR2AHTR2CHTR2B

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-2009125668-A1 TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE チッソ株式会社 (JP) 2009-10-15 — — WO disclosed
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