SCHEMBL30738857

SCHEMBL30738857

CC(C)(C)OC(=O)N[C@H](C#N)Cc1ccc(-c2ccc(C#N)cc2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 16/20 0.49
▸ CTSB P07858 6/20 0.49
▸ CTSL P07711 5/20 0.49
▸ CTSF Q9UBX1 5/20 0.49
▸ CTSS P25774 5/20 0.49
▸ CTSV O60911 3/20 0.49
▸ CTSC P53634 12/20 0.47

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
SCHEMBL24981995 0.87 CTSC (0.59) CTSKCTSBCTSSCTSC
SCHEMBL24982011 0.87 CTSK (0.46) CTSKCTSBCTSSCTSC
SCHEMBL24982366 0.85 CTSC (0.48) CTSKCTSBCTSSCTSC
SCHEMBL16064851 0.84 CTSC (0.63) CTSKCTSC
SCHEMBL16367098 0.84 CTSC (0.47) CTSKCTSBCTSSCTSC
SCHEMBL16064039 0.84 CTSC (0.63) CTSKCTSBCTSLCTSFCTSC
SCHEMBL24981572 0.84 CTSC (0.52) CTSKCTSC
SCHEMBL19154996 0.84 CTSS (0.52) CTSKCTSBCTSLCTSSCTSC
SCHEMBL30195065 0.83 CTSC (0.56) CTSKCTSSCTSC
SCHEMBL20162060 0.83 CTSC (0.56) CTSKCTSSCTSC

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-4561565-A2 NOVEL DPP1 INHIBITORS AND USES THEREOF Insmed Incorporated (US) 2025-06-04 — — EP disclosed
WO-2024026433-A2 NOVEL DPP1 INHIBITORS AND USES THEREOF INSMED INCORPORATED (US) 2024-02-01 — — WO disclosed
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