SCHEMBL11764265

SCHEMBL11764265

Nc1ccc2cc(C(=O)O)cc(O)c2c1N=Nc1ccc(NC(=O)Nc2ccc(N=Nc3c(N)ccc4cc(C(=O)O)cc(O)c34)c(S(=O)(=O)O)c2)cc1S(=O)(=O)O

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 9/20 0.72
▸ PRMT1 Q99873 3/20 0.49
▸ APEX1 P27695 2/20 0.47
▸ CD40 P25942 1/20 0.46
▸ CD40LG P29965 1/20 0.46
▸ SUMO2 P61956 1/20 0.43
▸ SUMO1 P63165 1/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ SENP2 Q9HC62 1/20 0.43
▸ PRMT3 O60678 1/20 0.38
▸ EP300 Q09472 1/20 0.38
▸ PRMT6 Q96LA8 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ PHLPP2 Q6ZVD8 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
SCHEMBL29637807 0.89 ENPP2 (0.85) ENPP2PRMT1APEX1CD40CD40LG
SCHEMBL10891093 0.89 ENPP2 (0.85) ENPP2PRMT1APEX1CD40CD40LG
SCHEMBL10891071 0.89 ENPP2 (0.85) ENPP2PRMT1APEX1CD40CD40LG
SCHEMBL30716918 0.89 ENPP2 (0.85) ENPP2PRMT1APEX1CD40CD40LG
SCHEMBL11594349 0.89 ENPP2 (0.85) ENPP2PRMT1APEX1CD40CD40LG
SCHEMBL11594336 0.88 ENPP2 (0.84) ENPP2PRMT1APEX1CD40CD40LG
SCHEMBL11760582 0.87 APEX1 (0.61) ENPP2PRMT1APEX1SUMO2SUMO1
SCHEMBL11760573 0.87 APEX1 (0.61) ENPP2PRMT1APEX1SUMO2SUMO1
SCHEMBL11761475 0.86 ENPP2 (0.52) ENPP2PRMT1APEX1
SCHEMBL11758959 0.83 ENPP2 (0.91) ENPP2PRMT1APEX1CD40CD40LG

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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