SCHEMBL7787177

SCHEMBL7787177

CCCCCCCCCC(CC)(c1ccccc1)S(=O)(=O)O

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 3/20 0.41
SCN9A Q15858 3/20 0.41
NAAA Q02083 2/20 0.40
ESR2 Q92731 1/20 0.39
GAA P10253 1/20 0.38
EGFR P00533 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
EPHX1 P07099 3/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37

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
SCHEMBL27970557 1.00 SCN5A (0.41) SCN5ASCN9ANAAAESR2GAA
SCHEMBL7786015 0.94 SCN5A (0.43) SCN5ASCN9ANAAAESR2GAA
SCHEMBL7784178 0.94 SCN5A (0.43) SCN5ASCN9ANAAAESR2GAA
SCHEMBL11795464 0.94 SCN5A (0.43) SCN5ASCN9ANAAAESR2GAA
SCHEMBL7783835 0.94 SCN5A (0.43) SCN5ASCN9ANAAAESR2GAA
SCHEMBL7783811 0.92 SCN5A (0.42) SCN5ASCN9ANAAAESR2GAA
SCHEMBL3109755 0.92 SCN5A (0.42) SCN5ASCN9ANAAAESR2GAA
SCHEMBL7787235 0.92 SCN5A (0.42) SCN5ASCN9ANAAAESR2GAA
SCHEMBL28132484 0.92 ESR2 (0.42) SCN5ASCN9ANAAAESR2GAA
SCHEMBL9750314 0.87 MMP1 (0.45) SCN5ASCN9A

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-0803548-B1 Colored thermoplastic resin composition ORIENT CHEMICAL IND (JP) 2001-10-24 EP disclosed
US-5827911-A BLACK DYE IS OBTAINED BY REACTION OF NIGROSINE AND ATLEAST ONE ANIONIC SURFACTANT SELECTED FROM SULFURIC ACID ESTER OR SALTS, PHSOPHORIC ACID ESTER OR SALTS, SULFONIC ACID OR SALTS AND CARBOXYLIC ACID OR SALTS ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-27 US disclosed
EP-0803548-A2 Colored thermoplastic resin composition ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1997-10-29 EP disclosed