SCHEMBL9531503

SCHEMBL9531503

C=CC(O)c1nccn1[N+](=O)[O-]

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL9534065 0.78 KMT2A (0.38) KMT2ACYP2D6
SCHEMBL10346936 0.71 CYP2D6 (0.36) KMT2ACYP2D6
SCHEMBL3207233 0.70 CYP2D6 (0.55) KMT2ACYP2D6
SCHEMBL5327661 0.69 CYP2D6 (0.33) CYP2D6
SCHEMBL7555585 0.67
Nitric Acid SCHEMBL28391259 0.66 CYP2C19 (0.38) KMT2ACYP2D6
SCHEMBL9531382 0.65 KMT2A (0.42) KMT2ACYP2D6
SCHEMBL11791609 0.64 MAPK1 (0.46) KMT2A
SCHEMBL63265 0.64
SCHEMBL3607267 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0325513-B1 PROCESS FOR THE PREPARATION OF 1-HYDROXYALKYL-2-METHYL-5-NITRO-IMIDAZOLES RHONE-POULENC SANTE (FR) 1993-04-07 EP claimed
EP-0519984-A1 PROCESS FOR PREPARING HYDROXYALKYL-1 NITRO-5 IMIDAZOLES Aventis Pharma S.A. (FR) 1992-12-30 EP claimed
EP-0324692-B1 PROCESS FOR THE PREPARATION OF HYDROXYALKYLATING AGENTS, THE AGENTS AS PREPARED AND THEIR USE RHONE-POULENC SANTE (FR) 1992-11-25 EP claimed
EP-0324691-B1 PROCESS FOR THE PREPARATION OF 1-HYDROXYALKYL-5-NITRO-IMIDAZOLES RHONE-POULENC SANTE (FR) 1991-12-27 EP claimed
WO-1991013877-A1 PROCESS FOR PREPARING HYDROXYALKYL-1 NITRO-5 IMIDAZOLES RHONE-POULENC RORER S.A. (FR) 1991-09-19 WO claimed
EP-0325513-A1 Process for the preparation of 1-hydroxyalkyl-2-methyl-5-nitro-imidazoles RHONE-POULENC SANTE (FR) 1989-07-26 EP claimed
EP-0324692-A1 Process for the preparation of hydroxyalkylating agents, the agents as prepared and their use RHONE-POULENC SANTE (FR) 1989-07-19 EP claimed
EP-0325513-B1 PROCESS FOR THE PREPARATION OF 1-HYDROXYALKYL-2-METHYL-5-NITRO-IMIDAZOLES RHONE-POULENC SANTE (FR) 1993-04-07 EP disclosed
EP-0519984-A1 PROCESS FOR PREPARING HYDROXYALKYL-1 NITRO-5 IMIDAZOLES Aventis Pharma S.A. (FR) 1992-12-30 EP disclosed
EP-0519984-A1 PROCESS FOR PREPARING HYDROXYALKYL-1 NITRO-5 IMIDAZOLES Aventis Pharma S.A. (FR) 1992-12-30 EP disclosed
EP-0324692-B1 PROCESS FOR THE PREPARATION OF HYDROXYALKYLATING AGENTS, THE AGENTS AS PREPARED AND THEIR USE RHONE-POULENC SANTE (FR) 1992-11-25 EP disclosed
EP-0324691-B1 PROCESS FOR THE PREPARATION OF 1-HYDROXYALKYL-5-NITRO-IMIDAZOLES RHONE-POULENC SANTE (FR) 1991-12-27 EP disclosed
WO-1991013877-A1 PROCESS FOR PREPARING HYDROXYALKYL-1 NITRO-5 IMIDAZOLES RHONE-POULENC RORER S.A. (FR) 1991-09-19 WO disclosed
WO-1991013877-A1 PROCESS FOR PREPARING HYDROXYALKYL-1 NITRO-5 IMIDAZOLES RHONE-POULENC RORER S.A. (FR) 1991-09-19 WO disclosed
EP-0325513-A1 Process for the preparation of 1-hydroxyalkyl-2-methyl-5-nitro-imidazoles RHONE-POULENC SANTE (FR) 1989-07-26 EP disclosed
EP-0324692-A1 Process for the preparation of hydroxyalkylating agents, the agents as prepared and their use RHONE-POULENC SANTE (FR) 1989-07-19 EP disclosed
EP-0324691-A1 Process for the preparation of 1-hydroxyalkyl-5-nitro-imidazoles RHONE-POULENC SANTE (FR) 1989-07-19 EP disclosed