SCHEMBL14765837

SCHEMBL14765837

CCCCOc1ccc(C2CCC(c3ccc(-c4ccc(OCCC)cc4)c(F)c3F)CC2)cc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 4/20 0.39
RAB9A P51151 1/20 0.35
RARA P10276 1/20 0.35
RARB P10826 1/20 0.35
SCN9A Q15858 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
KDM1A O60341 2/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
FFAR1 O14842 2/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
CYP2C9 P11712 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
PPARD Q03181 1/20 0.34

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
SCHEMBL14765685 0.98 FPR2 (0.36) FPR2RAB9ARARARARBSCN9A
SCHEMBL12733925 0.91 FPR2 (0.36) FPR2RARBSCN9AFFAR4KDM1A
SCHEMBL14765682 0.91 CNR2 (0.34) FPR2RAB9ARARARARBSCN9A
SCHEMBL14765677 0.88 CHRM2 (0.38) FPR2RAB9ARARARARBSCN9A
SCHEMBL12733928 0.88 FPR2 (0.38) FPR2SCN9AKDM1APDE4APDE4B
SCHEMBL14765801 0.88 KDM1A (0.44) FPR2FFAR4KDM1AFFAR1PPARD
SCHEMBL14766059 0.87 FFAR4 (0.37) FPR2RAB9ARARARARBFFAR4
SCHEMBL14766677 0.87 FFAR1 (0.42) FPR2FFAR4KDM1AFFAR1PDE4A
SCHEMBL12733929 0.87 FPR2 (0.37) FPR2SCN9AKDM1APDE4APDE4B
SCHEMBL12733930 0.87 FPR2 (0.37) FPR2SCN9AKDM1APDE4APDE4B

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