SCHEMBL5761074

SCHEMBL5761074

CC1CCC(CC(CC(=O)N2CCOCC2)C(=O)NC2(C#N)CCN(C3CCCC3)C2)CC1

nearest known ligand 0.98

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSS P25774 20/20 0.98

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
SCHEMBL7396896 0.99 CTSS (1.00) CTSS
SCHEMBL7398062 0.99 CTSS (1.00) CTSS
SCHEMBL5758474 0.99 CTSS (1.00) CTSS
SCHEMBL5760624 0.96 CTSS (0.94) CTSS
SCHEMBL5759165 0.93 CTSS (1.00) CTSS
SCHEMBL5758348 0.93 CTSS (1.00) CTSS
SCHEMBL5757415 0.93 CTSS (1.00) CTSS
SCHEMBL5757026 0.93 CTSS (1.00) CTSS
SCHEMBL5756362 0.91 CTSS (0.95) CTSS
SCHEMBL5758076 0.90 CTSS (0.84) CTSS

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-1204652-B1 NOVEL SUCCINATE DERIVATIVE COMPOUNDS USEFUL AS CYSTEINE PROTEASE INHIBITORS BOEHRINGER INGELHEIM PHARMA (US) 2006-05-17 EP claimed