SCHEMBL9718502

SCHEMBL9718502

O=C1NCC[N+]1(Cl)Br

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
SCHEMBL11141917 0.65
SCHEMBL7934645 0.59
SCHEMBL11848787 0.59
SCHEMBL2506985 0.59
SCHEMBL22462262 0.56
SCHEMBL8611532 0.55
SCHEMBL9058472 0.47 CRBN (0.47)
SCHEMBL42430 0.47
SCHEMBL21785045 0.47 CRBN (0.47)
SCHEMBL9827 0.47

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-0422126-A4 SOLID HALOGEN-CONTAINING COMPOSITION AND METHOD FOR PRODUCING SAME 1992-07-01 EP disclosed
US-5106559-A Contained colored metal comopound PPG INDUSTRIES, INC. (US) 1992-04-21 US disclosed
US-5049385-A Disinfectant PPG INDUSTRIES, INC. (US) 1991-09-17 US disclosed
EP-0422126-A1 SOLID HALOGEN-CONTAINING COMPOSITION AND METHOD FOR PRODUCING SAME PPG INDUSTRIES, INC. (US) 1991-04-17 EP disclosed
EP-0239896-B1 N,N'-DIHALO-2-IMIDAZOLIDINONES PPG INDUSTRIES, INC. (US) 1990-09-05 EP disclosed
WO-1990000006-A1 SOLID HALOGEN-CONTAINING COMPOSITION AND METHOD FOR PRODUCING SAME PPG INDUSTRIES, INC. (US) 1990-01-11 WO disclosed
US-4874532-A Method for decontamination of toxic chemical agents PPG INDUSTRIES, INC. (US) 1989-10-17 US disclosed
US-4767542-A CHLORO-AND BROMO DERIVATIVES PPG INDUSTRIES, INC. (US) 1988-08-30 US disclosed
US-4681948-A BACTERICIDE PPG INDUSTRIES, INC. (US) 1987-07-21 US disclosed