SCHEMBL10653539

SCHEMBL10653539

CC(O)C(C(=O)S)C(C)(C)C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TP53 P04637 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
SCHEMBL607502 0.76 TP53 (0.45) TP53
SCHEMBL607505 0.76 TP53 (0.45) TP53
SCHEMBL17915472 0.76 TP53 (0.32) TP53
SCHEMBL24634162 0.74 CA1 (0.31) TP53
SCHEMBL26378526 0.70 TP53 (0.33) TP53
SCHEMBL19928307 0.70 MMP2 (0.37)
SCHEMBL3724478 0.70
SCHEMBL6721884 0.69
SCHEMBL27339 0.66
SCHEMBL2931616 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0181581-B1 BETA-AMINOTHIOL ESTER AND PROCESS FOR PREPARING THEREOF SAGAMI CHEMICAL RESEARCH CENTER (JP) 1988-07-13 EP disclosed
US-4728746-A INTERMEDIATES FOR CARBAPENICILLINS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1988-03-01 US disclosed
EP-0181581-A1 beta-Aminothiol ester and process for preparing thereof SAGAMI CHEMICAL RESEARCH CENTER (JP) 1986-05-21 EP disclosed