SCHEMBL11764704

SCHEMBL11764704

Nc1ccc(C(=O)O)c(N=Nc2c(N)ccc3cc(S(=O)(=O)O)cc(O)c23)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APEX1 P27695 2/20 0.58
▸ ENPP2 Q13822 2/20 0.57
▸ SUMO2 P61956 2/20 0.51
▸ SUMO1 P63165 2/20 0.51
▸ SENP7 Q9BQF6 2/20 0.51
▸ SENP2 Q9HC62 2/20 0.51
▸ CYP1A2 P05177 2/20 0.47
▸ NT5E P21589 2/20 0.46
▸ PTPN11 Q06124 2/20 0.43
▸ CASP6 P55212 2/20 0.43
▸ NSD2 O96028 1/20 0.43
▸ DUSP3 P51452 1/20 0.43
▸ PTPN5 P54829 1/20 0.43
▸ PRMT1 Q99873 2/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ PHLPP2 Q6ZVD8 1/20 0.40
▸ CYP2C9 P11712 1/20 0.39
▸ DNASE1L3 Q13609 1/20 0.39
▸ SENP3 Q9H4L4 1/20 0.39

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
SCHEMBL11764688 1.00 APEX1 (0.58) APEX1ENPP2SUMO2SUMO1SENP7
SCHEMBL11767724 0.92 APEX1 (0.60) APEX1ENPP2SUMO2SUMO1SENP7
SCHEMBL11767738 0.92 APEX1 (0.60) APEX1ENPP2SUMO2SUMO1SENP7
SCHEMBL11759329 0.87 ENPP2 (0.65) APEX1ENPP2SUMO2SUMO1SENP7
SCHEMBL11764842 0.87 APEX1 (0.62) APEX1ENPP2SUMO2SUMO1SENP7
SCHEMBL11759303 0.87 ENPP2 (0.65) APEX1ENPP2SUMO2SUMO1SENP7
SCHEMBL11764830 0.87 APEX1 (0.62) APEX1ENPP2SUMO2SUMO1SENP7
SCHEMBL6346835 0.84 APEX1 (0.73) APEX1ENPP2SUMO2SUMO1SENP7
SCHEMBL11670482 0.84 APEX1 (0.73) APEX1ENPP2SUMO2SUMO1SENP7
SCHEMBL11670965 0.84 APEX1 (0.73) APEX1ENPP2SUMO2SUMO1SENP7

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-4049640-A Substituted bisnaphthylazo diphenyl ureido complement inhibitors AMERICAN CYANAMID COMPANY (US) 1977-09-20 — — US disclosed
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