SCHEMBL6726725

SCHEMBL6726725

NC(=O)Nc1cc(N)ccc1/N=N/c1cc2c(S(=O)(=O)O)cccc2cc1S(=O)(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SUMO2 P61956 3/20 0.45
▸ SUMO1 P63165 3/20 0.45
▸ SENP7 Q9BQF6 3/20 0.45
▸ SENP2 Q9HC62 3/20 0.45
▸ ATIC P31939 2/20 0.45
▸ CYP1A2 P05177 2/20 0.39
▸ CTRB1 P17538 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ GAA P10253 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ TTR P02766 2/20 0.38
▸ NSD2 O96028 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ APEX1 P27695 1/20 0.38
▸ APOBEC3A P31941 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ CASP6 P55212 1/20 0.38
▸ APOBEC3G Q9HC16 1/20 0.38

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
SCHEMBL18218116 0.89 ATIC (0.40) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL9238793 0.87 NT5E (0.41) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL4699280 0.87 NT5E (0.41) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL6030186 0.87 NT5E (0.41) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL7127943 0.87 SENP2 (0.47) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL9238781 0.86 NT5E (0.41) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL11425279 0.85 ALDH1A1 (0.44) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL15985963 0.84 CYP1A2 (0.51) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL13388672 0.83 SENP2 (0.68) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL18218150 0.83 MEN1 (0.39) SUMO2SUMO1SENP7SENP2ATIC

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-8562694-B2 Fibre-reactive azo dyes, their preparation and their use HUNTSMAN INTERNATIONAL LLC (US) 2013-10-22 — — US disclosed
US-20120117737-A1 Fibre-Reactive Azo Dyes, Their Preparation And Their Use Huntsman Advanced Materials (Switzerland) GNBH (CH) 2012-05-17 — — US disclosed
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