SCHEMBL14765808

SCHEMBL14765808

CCCCOC1CCC(c2ccc(/C=C/C3CCC(c4ccc(OCC)c(F)c4)CC3)c(F)c2F)CC1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.37
SCN9A Q15858 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
SCHEMBL14765835 0.97 KDM1A (0.33) KDM1ASCN9A
SCHEMBL14765864 0.95 KDM1A (0.33) KDM1ASCN9A
SCHEMBL14765691 0.92 KDM1A (0.40) KDM1A
SCHEMBL14765831 0.92 SCN9A (0.31) KDM1ASCN9A
SCHEMBL14766884 0.91 ACACB (0.31)
SCHEMBL14765715 0.91 ACACB (0.31)
SCHEMBL12734096 0.88 SCN9A (0.33) KDM1ASCN9A
SCHEMBL12823208 0.88 KDM1A (0.40) KDM1A
SCHEMBL14766850 0.88 SCN9A (0.32) SCN9A
SCHEMBL14765810 0.88 SCN9A (0.32) SCN9A

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed