SCHEMBL14280292

SCHEMBL14280292

CC(=O)SCCN(CCSC(C)=O)S(C)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.40
POLB P06746 1/20 0.39
BLM P54132 1/20 0.39
ATM Q13315 1/20 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
SCHEMBL8376223 0.72
SCHEMBL11341608 0.71 CYP2C19 (0.41) CYP2C19POLBBLMATM
SCHEMBL10640370 0.70 CYP2C19 (0.44) CYP2C19POLBBLMATM
SCHEMBL24316274 0.70 CYP2C19 (0.40) CYP2C19POLBBLMATM
SCHEMBL22551299 0.69 CYP2C19 (0.60) CYP2C19POLBBLMATM
SCHEMBL10582483 0.68 MAPT (0.47) CYP2C19POLBBLMATM
SCHEMBL10583033 0.68 CYP2C19 (0.43) CYP2C19POLBBLMATM
SCHEMBL24317698 0.67 CYP2C19 (0.38) CYP2C19POLBBLMATM
SCHEMBL7117978 0.67 CYP2C19 (0.41) CYP2C19POLBBLMATM
SCHEMBL13996416 0.67 CYP2C19 (0.41) CYP2C19POLBBLMATM

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-7314959-B2 Amino thiol compounds and compositions for use in conjunction with cancer therapy WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-01-01 US disclosed
US-7314959-B2 Amino thiol compounds and compositions for use in conjunction with cancer therapy WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-01-01 US disclosed