SCHEMBL6959860

SCHEMBL6959860

CN1COC[N]C1=N[N+](=O)[O-]

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
SCHEMBL6959854 1.00
SCHEMBL3226453 0.72
SCHEMBL424752 0.69
SCHEMBL10060050 0.69
SCHEMBL2755012 0.63
SCHEMBL422028 0.62 POLB (0.32)
SCHEMBL8546879 0.62
SCHEMBL7982091 0.55 MAPT (0.41)
SCHEMBL7982094 0.55 MAPT (0.41)
SCHEMBL3226313 0.55 MAPT (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0850231-B1 PROCESS FOR PREPARING A 2-CHLORO-5-CHLOROMETHYL-THIAZOLE COMPOUND SYNGENTA PARTICIPATIONS AG (CH) 2003-04-02 EP claimed
US-6187927-B1 REACTING 2-CHLOROALLYLFORMAMIDE WITH DEHYDRATING, HALOGENATING, AND SULFURIZING AGENTS NOVARTIS CROP PROTECTION, INC. 2001-02-13 US claimed
EP-0850231-A1 PROCESS FOR PREPARING A 2-CHLORO-5-CHLOROMETHYL-THIAZOLE COMPOUND Novartis AG (CH) 1998-07-01 EP claimed
WO-1997010226-A1 PROCESS FOR PREPARING A 2-CHLORO-5-CHLOROMETHYL-THIAZOLE COMPOUND NOVARTIS AG (CH) 1997-03-20 WO claimed
EP-0850231-B1 PROCESS FOR PREPARING A 2-CHLORO-5-CHLOROMETHYL-THIAZOLE COMPOUND SYNGENTA PARTICIPATIONS AG (CH) 2003-04-02 EP disclosed
EP-0850231-B1 PROCESS FOR PREPARING A 2-CHLORO-5-CHLOROMETHYL-THIAZOLE COMPOUND SYNGENTA PARTICIPATIONS AG (CH) 2003-04-02 EP disclosed
US-6187927-B1 REACTING 2-CHLOROALLYLFORMAMIDE WITH DEHYDRATING, HALOGENATING, AND SULFURIZING AGENTS NOVARTIS CROP PROTECTION, INC. 2001-02-13 US disclosed
US-6187927-B1 REACTING 2-CHLOROALLYLFORMAMIDE WITH DEHYDRATING, HALOGENATING, AND SULFURIZING AGENTS NOVARTIS CROP PROTECTION, INC. 2001-02-13 US disclosed
EP-0850231-A1 PROCESS FOR PREPARING A 2-CHLORO-5-CHLOROMETHYL-THIAZOLE COMPOUND Novartis AG (CH) 1998-07-01 EP disclosed
EP-0850231-A1 PROCESS FOR PREPARING A 2-CHLORO-5-CHLOROMETHYL-THIAZOLE COMPOUND Novartis AG (CH) 1998-07-01 EP disclosed
WO-1997010226-A1 PROCESS FOR PREPARING A 2-CHLORO-5-CHLOROMETHYL-THIAZOLE COMPOUND NOVARTIS AG (CH) 1997-03-20 WO disclosed
WO-1997010226-A1 PROCESS FOR PREPARING A 2-CHLORO-5-CHLOROMETHYL-THIAZOLE COMPOUND NOVARTIS AG (CH) 1997-03-20 WO disclosed