SCHEMBL11761475

SCHEMBL11761475

Nc1ccc2cc(C(=O)O)cc(O)c2c1N=Nc1ccc(NC(=O)Nc2ccc(N=Nc3c(N)ccc4cc(C(=O)O)cc(O)c34)c(C(=O)O)c2)cc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 2/20 0.52
▸ PRMT1 Q99873 2/20 0.50
▸ APEX1 P27695 2/20 0.41
▸ PIM1 P11309 1/20 0.38
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ PLAU P00749 1/20 0.35
▸ HPSE Q9Y251 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ RNASEH1 O60930 1/20 0.33
▸ PTPN11 Q06124 1/20 0.33
▸ GPR35 Q9HC97 1/20 0.33
▸ ATG4B Q9Y4P1 1/20 0.33

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
SCHEMBL11759399 0.87 ENPP2 (0.68) ENPP2PRMT1APEX1
SCHEMBL11759424 0.87 ENPP2 (0.68) ENPP2PRMT1APEX1
SCHEMBL11764265 0.86 ENPP2 (0.72) ENPP2PRMT1APEX1
SCHEMBL11764643 0.81 APEX1 (0.56) ENPP2APEX1KMT2AMEN1POLB
SCHEMBL11764638 0.81 APEX1 (0.56) ENPP2APEX1KMT2AMEN1POLB
SCHEMBL11759303 0.79 ENPP2 (0.65) ENPP2PRMT1APEX1
SCHEMBL11759329 0.79 ENPP2 (0.65) ENPP2PRMT1APEX1
SCHEMBL11761477 0.79 HSD17B10 (0.41) ENPP2PRMT1APEX1KMT2AMEN1
SCHEMBL10891071 0.74 ENPP2 (0.85) ENPP2PRMT1APEX1MAPK1
SCHEMBL11594349 0.74 ENPP2 (0.85) ENPP2PRMT1APEX1MAPK1

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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