SCHEMBL30739123

SCHEMBL30739123

Cn1c(=O)oc2ccc(-c3ccc(C[C@@H](C#N)NC(=O)CC4(NC(=O)OC(C)(C)C)CCCCC4)cc3)cc21

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 0.53
▸ KCNH2 Q12809 2/20 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
SCHEMBL16478182 0.89 CTSC (0.56) CTSCKCNH2
SCHEMBL16478184 0.89 CTSC (0.56) CTSCKCNH2
SCHEMBL30194946 0.85 CTSC (0.60) CTSCKCNH2
SCHEMBL16940311 0.85 CTSC (0.60) CTSCKCNH2
SCHEMBL20162066 0.85 CTSC (0.60) CTSCKCNH2
SCHEMBL30738897 0.85 CTSC (0.60) CTSCKCNH2
SCHEMBL9886045 0.84 CTSC (0.55) CTSCKCNH2
SCHEMBL31758068 0.84 CTSC (0.53) CTSCKCNH2
SCHEMBL30738869 0.83 CTSC (0.54) CTSCKCNH2
SCHEMBL30738851 0.82 CTSC (0.54) CTSCKCNH2

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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