SCHEMBL30738847

SCHEMBL30738847

Cn1c(=O)oc2ccc(-c3ccc(C[C@@H](C#N)NC(=O)[C@@H]4C[C@@H]5COC[C@@H]5N4)c(F)c3)cc21

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 0.72
▸ CTSK P43235 11/20 0.63

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
SCHEMBL30738901 0.95 CTSC (0.65) CTSCCTSK
SCHEMBL27382282 0.91 CTSC (0.79) CTSCCTSK
SCHEMBL30738885 0.91 CTSC (0.79) CTSCCTSK
SCHEMBL27381955 0.91 CTSC (0.79) CTSCCTSK
SCHEMBL27381740 0.89 CTSC (0.82) CTSC
SCHEMBL27382092 0.89 CTSC (0.82) CTSC
SCHEMBL27382097 0.89 CTSC (0.82) CTSC
SCHEMBL27382094 0.89 CTSC (0.82) CTSC
SCHEMBL31758495 0.88 CTSC (0.58) CTSCCTSK
SCHEMBL30738871 0.87 CTSC (0.64) 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 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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