SCHEMBL8936770

SCHEMBL8936770

C/C=C/C1CC=C(c2ccc(-c3ccc(-c4ccc(OCC)c(F)c4F)cc3)c(F)c2)CC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.33
KDM1A O60341 2/20 0.31
FGFR2 P21802 2/20 0.30
FGFR1 P11362 1/20 0.30
PDE5A O76074 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
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
SCHEMBL8936786 0.93 GABRA1 (0.32)
SCHEMBL8938052 0.93 NAAA (0.35) NAAAKDM1AFGFR2FGFR1
SCHEMBL8936825 0.92 CCNT1 (0.32)
SCHEMBL8936745 0.91 RARB (0.31)
SCHEMBL8936866 0.91 RARB (0.33)
SCHEMBL8936819 0.91 RARB (0.33)
SCHEMBL8936814 0.91 RARB (0.33)
SCHEMBL8936787 0.91 RARB (0.33)
SCHEMBL8964636 0.91 NAAA (0.31) NAAA
SCHEMBL8939204 0.91 FGFR1 (0.31) FGFR2FGFR1ESR1

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 2 patents. 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
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