SCHEMBL30738899

SCHEMBL30738899

N#Cc1ccc(-c2ccc(C[C@@H](C#N)NC(=O)[C@@H]3CNCCCO3)c(F)c2)cc1

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 0.75
▸ KCNH2 Q12809 2/20 0.75

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
SCHEMBL29032462 0.94 CTSC (0.78) CTSCKCNH2
SCHEMBL29038835 0.94 CTSC (0.78) CTSCKCNH2
SCHEMBL24982019 0.89 CTSC (0.70) CTSCKCNH2
SCHEMBL25146226 0.89 CTSC (0.67) CTSCKCNH2
SCHEMBL25146431 0.89 CTSC (0.70) CTSCKCNH2
SCHEMBL24981691 0.89 CTSC (0.70) CTSCKCNH2
SCHEMBL24981997 0.89 CTSC (0.70) CTSCKCNH2
SCHEMBL25146445 0.89 CTSC (0.67) CTSCKCNH2
SCHEMBL25146235 0.89 CTSC (0.70) CTSCKCNH2
SCHEMBL24981568 0.89 CTSC (0.67) 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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