SCHEMBL30738911

SCHEMBL30738911

Cn1c(=O)oc2ccc(-c3ccc(C[C@@H](C#N)NC(=O)C4(CN)CCC4)cc3)cc21

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 0.60
▸ KCNH2 Q12809 1/20 0.50
▸ CTSK P43235 1/20 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
SCHEMBL16485745 0.88 CTSC (0.62) CTSCKCNH2CTSK
SCHEMBL16485744 0.87 CTSC (0.61) CTSCKCNH2CTSK
SCHEMBL31757925 0.86 CTSC (0.59) CTSCKCNH2CTSK
SCHEMBL30738851 0.85 CTSC (0.54) CTSCKCNH2CTSK
SCHEMBL2884964 0.84 CTSC (0.66) CTSCKCNH2CTSK
SCHEMBL2884960 0.84 CTSC (0.66) CTSCKCNH2CTSK
SCHEMBL30738897 0.84 CTSC (0.60) CTSCKCNH2CTSK
SCHEMBL16934691 0.83 CTSC (0.66) CTSCKCNH2
SCHEMBL21924553 0.83 CTSC (0.66) CTSCKCNH2
SCHEMBL31757820 0.82 CTSC (0.60) CTSCKCNH2CTSK

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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