SCHEMBL7140645

SCHEMBL7140645

CS(=O)(=O)N1CC(S)CC1CCCn1cccc1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 1/20 0.33
TP53 P04637 1/20 0.32

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
SCHEMBL5406222 1.00 ECE1 (0.33) ECE1TP53
SCHEMBL6810715 0.71 GLA (0.36) ECE1
SCHEMBL5404053 0.71 ECE1 (0.33) ECE1
SCHEMBL5404048 0.71 ECE1 (0.33) ECE1
SCHEMBL7144794 0.70 ECE1 (0.41) ECE1
SCHEMBL5415653 0.70 ECE1 (0.41) ECE1
SCHEMBL5412971 0.68 ECE1 (0.43) ECE1
SCHEMBL5407509 0.67 ECE1 (0.42) ECE1
SCHEMBL5411627 0.65 ECE1 (0.43) ECE1
SCHEMBL5407304 0.64 ECE1 (0.45) ECE1

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
EP-1303486-A1 PYRROLIDINE DERIVATIVES AS METALLOPROTEASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2003-04-23 EP disclosed
WO-2002008185-A1 PYRROLIDINE DERIVATIVES AS METALLOPROTEASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2002-01-31 WO disclosed