SCHEMBL9837210

SCHEMBL9837210

CSC(c1cc2c(s1)CC(C(=O)O)CC2)C(O)(C=S)n1ccnc1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 6/20 0.48
PDK1 Q15118 1/20 0.30

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
SCHEMBL9834711 0.92 TBXAS1 (0.39) TBXAS1
SCHEMBL9837315 0.77 TBXAS1 (0.46) TBXAS1
SCHEMBL10551166 0.73 TBXAS1 (0.36) TBXAS1
SCHEMBL9837207 0.68 TBXAS1 (0.58) TBXAS1
SCHEMBL10772058 0.68 TBXAS1 (0.39) TBXAS1
SCHEMBL9837142 0.65 TBXAS1 (1.00) TBXAS1
Hydrochloric Acid SCHEMBL9836713 0.65 TBXAS1 (0.98) TBXAS1
SCHEMBL9871883 0.64 TBXAS1 (0.51) TBXAS1PDK1
SCHEMBL9837013 0.64 TBXAS1 (1.00) TBXAS1PDK1
SCHEMBL9835122 0.64 TBXAS1 (0.70) TBXAS1

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-0240107-B1 THIANAPHTHENE DERIVATIVES, THEIR PRODUCTION AND USE Sankyo Company Limited (JP) 1991-08-21 EP disclosed