SCHEMBL7363745

SCHEMBL7363745

CN(Cc1ccccc1)CC(C#N)(CCNC(=O)C(CC(=O)N1CCOCC1)CC1CCCCC1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSS P25774 19/20 0.55
CTSL P07711 4/20 0.46
CTSK P43235 3/20 0.46
REN P00797 1/20 0.44

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
SCHEMBL5759218 0.83 CTSS (0.61) CTSSCTSLCTSKREN
SCHEMBL5757363 0.77 CTSS (0.61) CTSSCTSL
SCHEMBL5758603 0.77 CTSS (0.61) CTSSCTSL
SCHEMBL5757358 0.77 CTSS (0.61) CTSSCTSL
SCHEMBL5760517 0.74 CTSS (0.77) CTSSCTSLCTSKREN
SCHEMBL5758379 0.73 CTSS (0.66) CTSSCTSLCTSK
SCHEMBL5756972 0.73 CTSS (0.73) CTSSCTSLCTSKREN
SCHEMBL5760506 0.72 CTSS (0.76) CTSSCTSLCTSKREN
SCHEMBL5761262 0.71 CTSS (1.00) CTSSCTSLCTSK
SCHEMBL5758384 0.69 CTSS (1.00) CTSSCTSLCTSK

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-1204652-A1 NOVEL SUCCINATE DERIVATIVE COMPOUNDS USEFUL AS CYSTEINE PROTEASE INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2002-05-15 EP disclosed
WO-2001009110-A1 NOVEL SUCCINATE DERIVATIVE COMPOUNDS USEFUL AS CYSTEINE PROTEASE INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2001-02-08 WO disclosed