SCHEMBL8949101

SCHEMBL8949101

C/C=C/C1COC(c2ccc(-c3ccc(-c4ccc(OCCCC)c(F)c4F)cc3)c(F)c2)OC1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 6/20 0.33
PPARD Q03181 1/20 0.32
KDM1A O60341 2/20 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
SCHEMBL8949048 0.97 FPR2 (0.34) FPR2PPARDKDM1A
SCHEMBL8949154 0.96 FPR2 (0.33) FPR2PPARD
SCHEMBL8949094 0.96 FPR2 (0.33) FPR2PPARD
SCHEMBL8949059 0.96 FPR2 (0.33) FPR2PPARD
SCHEMBL8949133 0.96 FPR2 (0.33) FPR2PPARD
SCHEMBL8949009 0.95 FPR2 (0.36) FPR2KDM1A
SCHEMBL8949049 0.92 KDM1A (0.37) FPR2KDM1A
SCHEMBL8948914 0.90 CNR2 (0.36) FPR2PPARDKDM1A
SCHEMBL13000157 0.89 FPR2 (0.31) FPR2
SCHEMBL8940209 0.88 KDM1A (0.31) PPARDKDM1A

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