SCHEMBL9852609

SCHEMBL9852609

C#CCOc1nc2cc(N3C(=O)C(C)=C(C)C3=O)c(F)cc2s1

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PPOX P50336 9/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL10445806 0.72 PPOX (0.41) PPOX
SCHEMBL9852620 0.72 GAA (0.35) PPOX
SCHEMBL10445824 0.72 GRM7 (0.39) PPOX
SCHEMBL10690143 0.72 PPOX (0.43) PPOX
SCHEMBL10446092 0.71 GRM7 (0.38) PPOX
SCHEMBL9711627 0.71 PPOX (0.34) PPOX
SCHEMBL11117152 0.69 MAOB (0.41)
SCHEMBL9852614 0.69 GFER (0.47)
SCHEMBL18470247 0.65 PGK1 (0.36) PPOX
SCHEMBL11117595 0.64 PTGS1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0444764-A1 Process and intermediates for the preparation of substituted 1-benzothiazolyl-3,4-dimethyl-3-pyrrolin-2,5(1H)-diones SCHERING AKTIENGESELLSCHAFT (DE) 1991-09-04 EP disclosed