SCHEMBL8958994

SCHEMBL8958994

CCCCCC1CCC(C2CCC(c3ccc(-c4ccc(-c5ccc(OC)c(F)c5F)cc4)c(F)c3)CC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 6/20 0.34
CYP3A4 P08684 2/20 0.33
CYP2C9 P11712 2/20 0.33
FASN P49327 1/20 0.33
DPP4 P27487 1/20 0.32
APP P05067 2/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
KDM1A O60341 2/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
RARB P10826 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 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
SCHEMBL8959001 0.99 FPR2 (0.34) FPR2CYP3A4CYP2C9FASNDPP4
SCHEMBL8933024 0.97 FPR2 (0.36) FPR2CYP3A4CYP2C9FASNDPP4
SCHEMBL8933186 0.96 FPR2 (0.35) FPR2CYP3A4CYP2C9FASNDPP4
SCHEMBL8958723 0.93 FPR2 (0.36) FPR2CYP3A4CYP2C9FASNAPP
SCHEMBL8958831 0.92 KDM1A (0.36) FPR2CYP3A4CYP2C9FASNAPP
SCHEMBL8959038 0.91 KDM1A (0.35) FPR2CYP3A4CYP2C9FASNAPP
SCHEMBL8958840 0.91 PPARD (0.34) FPR2CYP3A4CYP2C9FASNAPP
SCHEMBL8959007 0.91 PPARD (0.34) FPR2CYP3A4CYP2C9FASNAPP
SCHEMBL8959087 0.90 RARB (0.34) FPR2CYP3A4CYP2C9FASNAPP
SCHEMBL8958883 0.90 RARB (0.34) FPR2CYP3A4CYP2C9FASNAPP

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-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