SCHEMBL9830964

SCHEMBL9830964

CC(O)c1ncc([N+](=O)[O-])[nH]1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.36
ATM Q13315 1/20 0.36
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
CHRM1 P11229 1/20 0.31
USP7 Q93009 1/20 0.30

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
SCHEMBL1441383 0.86 MAPK1 (0.38) MAPK1ATMMEN1USP2POLB
SCHEMBL11735795 0.85 MAPK1 (0.32) MAPK1ATMMEN1KMT2A
SCHEMBL9953612 0.81 MAPK1 (0.34) MAPK1ATMMEN1USP2POLB
SCHEMBL5045818 0.81 MAPK1 (0.34) MAPK1ATM
SCHEMBL11832305 0.78 MAPK1 (0.31) MAPK1ATM
SCHEMBL11830920 0.78 MAPK1 (0.31) MAPK1ATM
SCHEMBL11831691 0.78 MAPK1 (0.31) MAPK1ATM
SCHEMBL11750132 0.78 CHRM1 (0.35) MAPK1ATMCHRM1
SCHEMBL9710856 0.78 MEN1 (0.31) MEN1USP2POLBKMT2A
SCHEMBL1187005 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0324691-B1 PROCESS FOR THE PREPARATION OF 1-HYDROXYALKYL-5-NITRO-IMIDAZOLES RHONE-POULENC SANTE (FR) 1991-12-27 EP claimed
US-4925952-A Process for preparing 1-hydroxyalkyl-5-nitroimidazoles RHONE-POULENC SANTE (FR) 1990-05-15 US claimed
CN-1035288-A The preparation method of 1-hydroxyalkyl-5-nitroimidazole RHONE POULENC SANTE (FR) 1989-09-06 CN claimed
CN-1023318-C Process for preparing 1-hydroxyalkyl-5-nitro imidazoles RHONE POULENC SANTE (FR) 1993-12-29 CN disclosed
CN-1023220-C Process for preparing 1-hydroxyalkyl-2-methyl-5-nitro imidazoles RHONE POULENC SANTE (FR) 1993-12-22 CN disclosed
CN-1016782-B PROCESS FOR PREPARING 1-ETHYLOL-2-METHYL-5-NITROIMIDAZOLE RHONE POULENC SANTE (FR) 1992-05-27 CN disclosed
US-5023361-A Process for preparing hydroxyalkylating agents, the agents so obtained, and their use RHONE-POULENC SANTE (FR) 1991-06-11 US disclosed
US-4925950-A Process for preparing 1-hydroxyalkyl-5-nitroimidazole RHONE-POULENC SANTE (FR) 1990-05-15 US disclosed
US-4925951-A Process for preparing 1-hydroxyalkyl-2-methyl-5-nitroimidazoles RHONE-POULENC SANTE (FR) 1990-05-15 US disclosed
US-4925952-A Process for preparing 1-hydroxyalkyl-5-nitroimidazoles RHONE-POULENC SANTE (FR) 1990-05-15 US disclosed
CN-1035288-A The preparation method of 1-hydroxyalkyl-5-nitroimidazole RHONE POULENC SANTE (FR) 1989-09-06 CN disclosed
CN-1035289-A The preparation method of 1-hydroxyalkyl-2-methyl-5-nitro imidazoles RHONE POULENC SANTE (FR) 1989-09-06 CN disclosed
CN-1035111-A Hydroxyalkyl agent preparation method, gained new preparation and application thereof like this RHONE POULENC SANTE (FR) 1989-08-30 CN disclosed