SCHEMBL9533398

SCHEMBL9533398

C=CCn1cncc1[N+](=O)[O-]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.35
MAPT P10636 2/20 0.34
APOBEC3G Q9HC16 2/20 0.34
ALDH1A1 P00352 5/20 0.33
MAPK1 P28482 3/20 0.33
RAB9A P51151 2/20 0.33
GFER P55789 2/20 0.33
NPC1 O15118 1/20 0.33
S1PR4 O95977 1/20 0.33
S1PR1 P21453 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TLR9 Q9NR96 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ADORA2B P29275 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.32
TSHR P16473 1/20 0.32
ATM Q13315 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
SCHEMBL27381848 0.81 ALDH1A1 (0.33) ALDH1A1MAPK1RAB9ASMN1; SMN2LMNA
SCHEMBL11618755 0.78 ALDH1A1 (0.43) MAPTALDH1A1MAPK1RAB9AHTT
SCHEMBL11867255 0.76 ALDH1A1 (0.36) MAPTALDH1A1MAPK1RAB9ASMN1; SMN2
SCHEMBL11052393 0.76 CYP11B1 (0.37) MAPTALDH1A1LMNA
SCHEMBL28007794 0.75 MAPK1 (0.33) ALDH1A1MAPK1RAB9ASMN1; SMN2LMNA
SCHEMBL28060400 0.75 LMNA (0.35) ALDH1A1MAPK1RAB9ASMN1; SMN2LMNA
SCHEMBL9467304 0.75 LMNA (0.35) MAPTALDH1A1MAPK1RAB9AADORA2B
SCHEMBL16328893 0.75 LMNA (0.37) ALDH1A1MAPK1RAB9AADORA2BSMN1; SMN2
SCHEMBL5878432 0.75 LMNA (0.49) MAPTALDH1A1MAPK1RAB9AADORA2B
SCHEMBL11617013 0.75 LMNA (0.38) MAPTALDH1A1MAPK1RAB9AHTT

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1023221-C Process for preparing 1-alkyl-5-nitroimidazoles RHONE POULENC SANTE (FR) 1993-12-22 CN claimed
EP-0325512-B1 PROCESS FOR THE PREPARATION OF 1-ALKYL-5-NITRO-IMIDAZOLES RHONE-POULENC SANTE (FR) 1993-01-20 EP claimed
US-4925949-A Process for preparing 1-alkyl-5-nitroimidazoles RHONE-POULENC SANTE (FR) 1990-05-15 US claimed
CN-1035824-A The preparation method of 1-alkyl-5-nitroimidazole RHONE POULENC SANTE (FR) 1989-09-27 CN claimed
US-4021442-A Production of 1-alkyl-5-nitroimidazoles BASF AKTIENGESELLSCHAFT (DT) 1977-05-03 US claimed
JP-1213268-A None JP disclosed
CN-1023221-C Process for preparing 1-alkyl-5-nitroimidazoles RHONE POULENC SANTE (FR) 1993-12-22 CN disclosed
CN-1023221-C Process for preparing 1-alkyl-5-nitroimidazoles RHONE POULENC SANTE (FR) 1993-12-22 CN disclosed
CN-1023221-C Process for preparing 1-alkyl-5-nitroimidazoles RHONE POULENC SANTE (FR) 1993-12-22 CN disclosed
US-4925949-A Process for preparing 1-alkyl-5-nitroimidazoles RHONE-POULENC SANTE (FR) 1990-05-15 US disclosed
US-4925949-A Process for preparing 1-alkyl-5-nitroimidazoles RHONE-POULENC SANTE (FR) 1990-05-15 US disclosed
US-4925949-A Process for preparing 1-alkyl-5-nitroimidazoles RHONE-POULENC SANTE (FR) 1990-05-15 US disclosed
EP-0325512-A1 Process for the preparation of 1-alkyl-5-nitro-imidazoles RHONE-POULENC SANTE (FR) 1989-07-26 EP disclosed
EP-0043922-A1 Process for preparing 1,2-dimethyl-5-nitroimidazole BASF Aktiengesellschaft (DE) 1982-01-20 EP disclosed
US-4273783-A BACTERICIDES, FUNGICIDES, ANTIPROTOZOA AGENTS GRISSMAN CHEMICALS LIMITED (GB) 1981-06-16 US disclosed
US-4065567-A Substituted nitroimidazolyl thiadiazoles and oxadiazoles as antibacterial agents and growth promoting compounds AMERICAN CYANAMID COMPANY (US) 1977-12-27 US disclosed
US-4021442-A Production of 1-alkyl-5-nitroimidazoles BASF AKTIENGESELLSCHAFT (DT) 1977-05-03 US disclosed
US-4021442-A Production of 1-alkyl-5-nitroimidazoles BASF AKTIENGESELLSCHAFT (DT) 1977-05-03 US disclosed
US-4021442-A Production of 1-alkyl-5-nitroimidazoles BASF AKTIENGESELLSCHAFT (DT) 1977-05-03 US disclosed
US-3991200-A Substituted nitroimidazolyl thiadiazoles and oxadiazoles as antibacterial agents and growth promoting compounds AMERICAN CYANAMID COMPANY (US) 1976-11-09 US disclosed