SCHEMBL2850202

SCHEMBL2850202

C1=CNC=CC1.[N-]=[N+]=[N-]

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL2850212 0.88
SCHEMBL27199 0.86
Hydrochloric Acid SCHEMBL3854217 0.82
SCHEMBL1209814 0.82
Calcium SCHEMBL29393231 0.82
SCHEMBL31506470 0.79
SCHEMBL15321675 0.78
Hydroxyamine SCHEMBL10529382 0.76
Pyrrole SCHEMBL1986041 0.69
Carbamic Acid SCHEMBL10377016 0.67 ACHE (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1435954-B1 A PROCESS FOR THE PREPARATION OF HIGHlLY PUREAMLODIPINE BENZENESULFONATE LEK PHARMACEUTICALS (SI) 2010-01-13 EP disclosed
US-7153970-B2 High purity amlodipine benzenesulfonate and a process for its preparation LEK PHARMACEUTICALS D.D. (SI) 2006-12-26 US disclosed
US-20040176606-A1 High purity amlodipine benzenesulfonate and a process for its preparation FURLAN BORUT (SI) 2004-09-09 US disclosed
EP-1435954-A1 HIGH PURITY AMLODIPINE BENZENESULFONATE AND A PROCESS FOR ITS PREPARATION Lek Pharmaceutical and Chemical Co. D.D. (SI) 2004-07-14 EP disclosed
WO-2003004025-A1 HIGH PURITY AMLODIPINE BENZENESULFONATE AND A PROCESS FOR ITS PREPARATION LEK PHARMACEUTICAL AND CHEMICAL COMPANY D.D. (DE) 2003-01-16 WO disclosed