SCHEMBL31536758

SCHEMBL31536758

Cn1c(=O)oc2ccc(-c3ccc(C[C@@H](C#N)NC(=O)[C@H]4[C@H]5CC[C@H](C5)N4C(=O)OC(C)(C)C)c(F)c3)cc21

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 0.60
▸ CTSK P43235 11/20 0.58

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
SCHEMBL31536747 1.00 CTSC (0.60) CTSCCTSK
SCHEMBL31536744 1.00 CTSC (0.60) CTSCCTSK
SCHEMBL22643290 0.95 CTSC (0.65) CTSCCTSK
SCHEMBL16064078 0.95 CTSC (0.65) CTSCCTSK
SCHEMBL31536726 0.90 CTSC (0.71) CTSCCTSK
SCHEMBL16064241 0.87 CTSC (0.68) CTSCCTSK
SCHEMBL21076185 0.87 CTSC (0.68) CTSCCTSK
SCHEMBL30738997 0.86 CTSC (0.60) CTSCCTSK
SCHEMBL19155285 0.86 CTSC (0.61) CTSCCTSK
SCHEMBL16064476 0.86 CTSC (0.63) CTSCCTSK

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
WO-2025059526-A1 DIPEPTIDYL PEPTIDASE 1 INHIBITORS AND USES THEREOF INSMED INCORPORATED (US) 2025-03-20 — — WO disclosed
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