SCHEMBL8940213

SCHEMBL8940213

C/C=C/C1CCC(c2ccc(-c3ccc(-c4ccc(OCCCCC)c(F)c4F)cc3)c(F)c2)OC1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.31
FPR2 P25090 1/20 0.31
PPARD Q03181 1/20 0.30
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
SCHEMBL8940206 0.99 RARB (0.32) KDM1AFPR2RARB
SCHEMBL8940262 0.99 RARB (0.32) KDM1AFPR2RARB
SCHEMBL8940254 0.99 RARB (0.32) KDM1AFPR2RARB
SCHEMBL8940244 0.99 RARB (0.32) KDM1AFPR2RARB
SCHEMBL8940209 0.97 KDM1A (0.31) KDM1APPARD
SCHEMBL8940420 0.95 FPR2 (0.33) KDM1AFPR2
SCHEMBL8940193 0.93 KDM1A (0.36) KDM1AFPR2
SCHEMBL8940145 0.90 GABRA1 (0.34) KDM1AFPR2PPARDRARB
SCHEMBL8940149 0.90 GABRA1 (0.34) KDM1AFPR2PPARDRARB
SCHEMBL8940357 0.90 GABRA1 (0.34) KDM1AFPR2PPARDRARB

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