SCHEMBL9717753

SCHEMBL9717753

Cc1ccc(N=Nc2ccccc2[N+](=O)[O-])c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
MEN1 O00255 5/20 0.50
ALDH1A1 P00352 3/20 0.50
CYP1A2 P05177 2/20 0.50
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
PTPN11 Q06124 4/20 0.48
MAPT P10636 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
ALPL P05186 1/20 0.47
PLAU P00749 1/20 0.46
POLB P06746 3/20 0.45
HTT P42858 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HSP90AA1 P07900 1/20 0.45
THRB P10828 1/20 0.45
RECQL P46063 1/20 0.45
BLM P54132 1/20 0.45
BCL2L1 Q07817 1/20 0.45

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
SCHEMBL9717750 1.00 KMT2A (0.50) KMT2AMEN1ALDH1A1CYP1A2NPC1
SCHEMBL5184493 0.88 FTO (0.56) KMT2AMEN1ALDH1A1CYP1A2NPC1
SCHEMBL29459575 0.88 FTO (0.56) KMT2AMEN1ALDH1A1CYP1A2NPC1
SCHEMBL5184495 0.88 FTO (0.56) KMT2AMEN1ALDH1A1CYP1A2NPC1
SCHEMBL9182069 0.85 FTO (0.49) KMT2AMEN1ALDH1A1CYP1A2NPC1
SCHEMBL9182072 0.85 FTO (0.49) KMT2AMEN1ALDH1A1CYP1A2NPC1
SCHEMBL8081716 0.85 MEN1 (0.60) KMT2AMEN1ALDH1A1CYP1A2NPC1
SCHEMBL9177007 0.85 MEN1 (0.60) KMT2AMEN1ALDH1A1CYP1A2NPC1
SCHEMBL8081714 0.84 ALOX15 (0.54) KMT2AMEN1ALDH1A1CYP1A2NPC1
SCHEMBL30377516 0.83 KMT2A (0.54) KMT2AMEN1ALDH1A1CYP1A2NPC1

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
EP-0259530-B1 METHOD FOR PREPARING 2-PHENYLBENZOTRIAZOLES AND 2-PHENYLBENZOTRIAZOLE-N-OXIDES CHEMIPRO KASEI KAISHA LTD (JP) 1992-04-08 EP disclosed