SCHEMBL8943769

SCHEMBL8943769

CCCCOc1ccc(-c2ccc(-c3ccc(C4CCC(CCC)OC4)cc3F)cc2)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 7/20 0.34
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
ALOX5 P09917 1/20 0.32
PPARD Q03181 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
KDM1A O60341 2/20 0.31
FASN P49327 1/20 0.31
RARB P10826 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
SCHEMBL8943392 0.97 FPR2 (0.35) FPR2PDE4APDE4BPDE4CPDE4D
SCHEMBL8943323 0.96 FPR2 (0.35) FPR2ALOX5PPARDRARB
SCHEMBL8943400 0.96 FPR2 (0.35) FPR2ALOX5PPARDRARB
SCHEMBL8943307 0.96 FPR2 (0.35) FPR2ALOX5PPARDRARB
SCHEMBL8943429 0.96 FPR2 (0.35) FPR2ALOX5PPARDRARB
SCHEMBL8943493 0.95 FPR2 (0.34) FPR2PDE4APDE4BPDE4CPDE4D
SCHEMBL8943766 0.95 FPR2 (0.38) FPR2PDE4AALOX5KDM1AFASN
SCHEMBL8944272 0.94 FPR2 (0.33) FPR2PDE4APDE4BPDE4CPDE4D
SCHEMBL8943870 0.94 FPR2 (0.35) FPR2PDE4APDE4BPDE4CPDE4D
SCHEMBL8943376 0.93 KDM1A (0.37) FPR2ALOX5KDM1AFASN

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2206695-B1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2013-09-18 EP disclosed
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed