SCHEMBL15947445

SCHEMBL15947445

CCCCCCN1/C(=C/c2c(O)c(=O)c2=O)C(C)(C)c2cc(-c3ccc(C)s3)ccc21

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.31
CNR2 P34972 1/20 0.31
ERN1 O75460 1/20 0.31
PRMT5 O14744 1/20 0.30
CARM1 Q86X55 1/20 0.30
PRMT1 Q99873 1/20 0.30
PRMT8 Q9NR22 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
SCHEMBL19188640 1.00 SCN9A (0.31) SCN9ACNR2ERN1PRMT5CARM1
SCHEMBL12156974 0.90 TP53 (0.31) SCN9A
SCHEMBL12156980 0.90 TP53 (0.31) SCN9A
SCHEMBL12156981 0.90 SCN9A (0.30) SCN9A
SCHEMBL12156971 0.90 SCN9A (0.30) SCN9A
SCHEMBL19188641 0.86 HTT (0.39) ERN1
SCHEMBL12173641 0.86 CNR2 (0.37) SCN9ACNR2ERN1
SCHEMBL12156989 0.79
SCHEMBL12156972 0.79
SCHEMBL21314809 0.79 ALDH1A1 (0.43) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2362884-B1 A DYE COMPRISING A CHROMOPHORE TO WHICH AN ACYLOIN GROUP IS ATTACHED SONY CORP (JP) 2017-08-02 EP disclosed
US-9679702-B2 Dye comprising a chromophore to which an acyloin group is attached SONY CORPORATION (JP) 2017-06-13 US disclosed
US-20140224330-A1 DYE COMPRISING A CHROMOPHORE TO WHICH AN ACYLOIN GROUP IS ATTACHED SONY CORPORATION (JP) 2014-08-14 US disclosed