SCHEMBL91581

SCHEMBL91581

CCc1nc(N)sc1Br

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
SCHEMBL957228 0.77 POLB (0.42)
SCHEMBL5157352 0.76
SCHEMBL5911688 0.74
SCHEMBL2175079 0.74 ALDH1A1 (0.48)
SCHEMBL31176196 0.74
SCHEMBL19426063 0.73
SCHEMBL2177063 0.73
Hydrochloric Acid SCHEMBL10987975 0.73 ALDH1A1 (0.47)
SCHEMBL2175442 0.71 SMN1; SMN2 (0.34)
SCHEMBL11564617 0.71 CYP1A2 (0.46)

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
WO-2025133610-A1 INHIBITORY COMPOUNDS LOQUS23 THERAPEUTICS LIMITED (GB) 2025-06-26 WO disclosed
EP-4574817-A1 INHIBITORY COMPOUNDS LoQus23 Therapeutics Limited (GB) 2025-06-25 EP disclosed
US-8129415-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-03-06 US disclosed
US-7973051-B2 Aminothiazoles as FBPase inhibitors for diabetes HOFFMAN-LA ROCHE INC. (US) 2011-07-05 US disclosed
CN-101878211-A Aminothiazole derivs HOFFMANN LA ROCHE 2010-11-03 CN disclosed
EP-2227468-A1 AMINOTHIAZOLE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2010-09-15 EP disclosed
US-20090192196-A1 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2009-07-30 US disclosed
US-20090143448-A1 NEW AMINOTHIAZOLES AS FBPASE INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 US disclosed
WO-2009068467-A1 AMINOTHIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 WO disclosed