SCHEMBL9737754

SCHEMBL9737754

COc1nc(C)nc(N=[SH]C(O)=S)n1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.31

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
SCHEMBL10395131 0.68 GAA (0.34) GAA
SCHEMBL8844371 0.66 GAA (0.47) GAA
SCHEMBL1131131 0.66 GAA (0.47) GAA
SCHEMBL25752212 0.65 GAA (0.34) GAA
SCHEMBL13026224 0.65 GAA (0.34) GAA
SCHEMBL9738049 0.63 CRHBP (0.38) GAA
SCHEMBL9738003 0.63 GAA (0.34) GAA
SCHEMBL13026227 0.62 GAA (0.36) GAA
SCHEMBL13173439 0.61 GAA (0.40) GAA
SCHEMBL10638215 0.60 ADRA2A (0.40) GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5086177-A Chemical intermediate for herbicides BAYER AKTIENGESELLSCHAFT (DE) 1992-02-04 US disclosed
US-4980469-A Reacting isothiourea of nitrogen containing heterocycle with hydroxylamine derivative BAYER AKTIENGESELLSCHAFT (DE) 1990-12-25 US disclosed