SCHEMBL8788690

SCHEMBL8788690

[CH2]Nc1ccc([N+](=O)[O-])c2nonc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 11/20 0.66
KMT2A Q03164 11/20 0.66
MYC P01106 6/20 0.66
IDO1 P14902 4/20 0.66
POLB P06746 1/20 0.61
GAA P10253 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
USP2 O75604 1/20 0.61
HTT P42858 1/20 0.61
RECQL P46063 1/20 0.61
GSTM2 P28161 2/20 0.58
MAPT P10636 2/20 0.58
MAX P61244 2/20 0.58
PSMD14 O00487 1/20 0.58
RXFP1 Q9HBX9 1/20 0.58
MIF P14174 1/20 0.57
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
GSTP1 P09211 1/20 0.53
OPRK1 P41145 1/20 0.51

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
SCHEMBL7052057 0.85 GSTM2 (0.66) MEN1KMT2AMYCIDO1POLB
SCHEMBL612306 0.85 IDO1 (0.65) MEN1KMT2AMYCIDO1POLB
SCHEMBL27934659 0.85 MEN1 (0.64) MEN1KMT2AMYCIDO1POLB
SCHEMBL593192 0.85 MEN1 (0.64) MEN1KMT2AMYCIDO1POLB
SCHEMBL7904806 0.85 MEN1 (0.64) MEN1KMT2AMYCIDO1POLB
SCHEMBL9099360 0.85 MEN1 (0.64) MEN1KMT2AMYCIDO1POLB
SCHEMBL8788860 0.84 MEN1 (0.67) MEN1KMT2AMYCIDO1POLB
Hydrazine SCHEMBL28939827 0.83 MEN1 (0.62) MEN1KMT2AMYCIDO1POLB
SCHEMBL14266890 0.82 MEN1 (0.61) MEN1KMT2AMYCIDO1POLB
SCHEMBL12337785 0.81 IDO1 (0.60) MEN1KMT2AMYCIDO1POLB

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468470-B1 Benzimidazoles, medicaments containing them and process for their preparation THOMAE GMBH DR K (DE) 1997-04-16 EP claimed
EP-0468470-A1 Benzimidazoles, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-01-29 EP claimed
US-5684029-A HYPOTENSIVE AGENTS KARL THOMAE GMBH (DE) 1997-11-04 US disclosed
EP-0468470-B1 Benzimidazoles, medicaments containing them and process for their preparation THOMAE GMBH DR K (DE) 1997-04-16 EP disclosed
US-5587393-A ANGIOTENSIN ANTAGONIST USEFUL IN TREATING HYPERTENSION DR. KARL THOMAE GMBH (DE) 1996-12-24 US disclosed
US-5385925-A Benzimidazoles, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1995-01-31 US disclosed
EP-0468470-A1 Benzimidazoles, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-01-29 EP disclosed