SCHEMBL8935029

SCHEMBL8935029

CCCCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(OC)c(F)c4F)cc3)c(F)c2F)CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
FPR2 P25090 6/20 0.35
ALOX5AP P20292 2/20 0.35
FEN1 P39748 2/20 0.35
CNR2 P34972 5/20 0.34
CNR1 P21554 2/20 0.34
TRPV1 Q8NER1 1/20 0.33
DPP4 P27487 1/20 0.32
LYPLA1 O75608 1/20 0.32
LYPLA2 O95372 1/20 0.32
ABHD16A O95870 1/20 0.32

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
SCHEMBL8934938 0.99 FPR2 (0.36) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL8962193 0.97 GAA (0.34) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL8961952 0.96 FPR2 (0.34) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL19985501 0.94 GAA (0.38) GAAMAPTFPR2CNR2CNR1
SCHEMBL19985518 0.94 GAA (0.38) GAAMAPTFPR2CNR2CNR1
SCHEMBL19985516 0.94 GAA (0.38) GAAMAPTFPR2CNR2CNR1
SCHEMBL19985495 0.93 MAPT (0.36) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL8935034 0.91 GAA (0.36) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL12736235 0.91 FEN1 (0.36) FPR2ALOX5APFEN1TRPV1
SCHEMBL12740816 0.91 FEN1 (0.36) FPR2ALOX5APFEN1TRPV1

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