SCHEMBL29455599

SCHEMBL29455599

[2H]C([2H])([2H])n1c(=O)oc2ccc(-c3ccc(C[C@@H](C#N)NC(=O)[C@@H]4CNCCCO4)c(F)c3)cc21

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 0.73
▸ KCNH2 Q12809 2/20 0.66

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
SCHEMBL25146540 0.95 CTSC (0.81) CTSCKCNH2
SCHEMBL25370011 0.95 CTSC (0.81) CTSCKCNH2
SCHEMBL31167623 0.95 CTSC (0.81) CTSCKCNH2
SCHEMBL25370009 0.95 CTSC (0.81) CTSCKCNH2
SCHEMBL24981079 0.95 CTSC (0.81) CTSCKCNH2
SCHEMBL24981014 0.95 CTSC (0.81) CTSCKCNH2
SCHEMBL29294886 0.93 CTSC (0.77) CTSCKCNH2
SCHEMBL29294863 0.93 CTSC (0.77) CTSCKCNH2
Brensocatib SCHEMBL30738944 0.90 CTSC (0.90) CTSCKCNH2
SCHEMBL25865824 0.88 CTSC (0.69) 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 3 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
WO-2022042591-A1 NITRILE DERIVATIVE THAT ACTS AS INHIBITOR OF DIPEPTIDYL PEPTIDASE 1 AND USE THEREOF 四川海思科制药有限公司 2022-03-03 — — WO disclosed
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