SCHEMBL8978053

SCHEMBL8978053

Nc1ccc(/C=C/c2cccc(N)c2S(=O)(=O)O)c(S(=O)(=O)O)c1-c1ccnnn1

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SUMO2 P61956 1/20 0.30
SUMO1 P63165 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP3 Q9H4L4 1/20 0.30
SENP2 Q9HC62 1/20 0.30
SENP1 Q9P0U3 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
SCHEMBL4056348 0.93 SUMO2 (0.31) SUMO2SUMO1SENP7SENP3SENP2
SCHEMBL8039451 0.83 SENP2 (0.37) SUMO2SUMO1SENP7SENP3SENP2
SCHEMBL8039469 0.83 SENP2 (0.37) SUMO2SUMO1SENP7SENP3SENP2
SCHEMBL3113183 0.78
SCHEMBL9347253 0.77
SCHEMBL7549672 0.76 TTR (0.44) SUMO2SUMO1SENP7SENP3SENP2
SCHEMBL38675 0.76 TTR (0.44) SUMO2SUMO1SENP7SENP3SENP2
SCHEMBL11656743 0.75 TTR (0.43) SUMO2SUMO1SENP7SENP3SENP2
SCHEMBL5490445 0.74
SCHEMBL28965317 0.74 DHFR (0.37)

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
EP-0709226-A1 Coating formulations for thermal papers CIBA-GEIGY AG (CH) 1996-05-01 EP claimed
EP-0709226-A1 Coating formulations for thermal papers CIBA-GEIGY AG (CH) 1996-05-01 EP disclosed