SCHEMBL8362152

SCHEMBL8362152

O=[N+]([O-])C(Br)(Br)CCO

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
SCHEMBL3293711 0.83 LMNA (0.46)
SCHEMBL421475 0.78
SCHEMBL400262 0.77
SCHEMBL6927423 0.72 LMNA (0.42)
SCHEMBL15494056 0.72 LMNA (0.42)
SCHEMBL9548584 0.72 LMNA (0.42)
SCHEMBL9509880 0.70 LMNA (0.40)
SCHEMBL9979299 0.70 LMNA (0.40)
Bronopol SCHEMBL28857973 0.70 LMNA (0.81)
SCHEMBL7781961 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0373759-B1 COMPOUND, COMPOSITION, PROCESS AND USE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-06-09 EP claimed
US-5112871-A ANTI-MICROBIAL BROMO-NITRO COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-05-12 US claimed
EP-0373759-A1 Compound, composition, process and use IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-20 EP claimed
JP-2193948-A None JP disclosed
WO-1999045975-A1 NON-WOVEN MATERIAL COMPRISING CYCLIC THIOHYDROXAMIC ACID AVECIA LIMITED (GB) 1999-09-16 WO disclosed
EP-0373759-B1 COMPOUND, COMPOSITION, PROCESS AND USE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-06-09 EP disclosed
US-5112871-A ANTI-MICROBIAL BROMO-NITRO COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-05-12 US disclosed
JP-H02193948-A ANTI-MICROBIAL COMPOUND AND PRODUCTION THEREOF IMPERIAL CHEM IND PLC <ICI> 1990-07-31 JP disclosed
EP-0373759-A1 Compound, composition, process and use IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-20 EP disclosed