SCHEMBL8939896

SCHEMBL8939896

CCCCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(OCC)c(F)c4F)cc3)c(F)c2)OC1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.35
FPR2 P25090 3/20 0.33
RARB P10826 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
FASN P49327 1/20 0.31
ESR1 P03372 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
SCHEMBL8932645 0.99 KDM1A (0.35) KDM1AFPR2RARBGRIN1GRIN2B
SCHEMBL8939930 0.96 RARB (0.33) KDM1AFPR2RARBFASN
SCHEMBL8939763 0.96 RARB (0.33) KDM1AFPR2RARBFASN
SCHEMBL8939747 0.96 RARB (0.33) KDM1AFPR2RARBFASN
SCHEMBL8939904 0.96 RARB (0.33) KDM1AFPR2RARBFASN
SCHEMBL8939911 0.96 RARB (0.33) KDM1AFPR2RARBFASN
SCHEMBL8939913 0.96 RARB (0.33) KDM1AFPR2RARBFASN
SCHEMBL8939887 0.96 KDM1A (0.32) KDM1AFPR2RARBFASN
SCHEMBL8939771 0.96 RARB (0.33) KDM1AFPR2RARBFASN
SCHEMBL8939749 0.96 RARB (0.33) KDM1AFPR2RARBFASN

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