SCHEMBL31095777

SCHEMBL31095777

Cn1c(=O)oc2ccc(-c3ccc4cc(CC(C#N)NC(=O)[C@@H]5CN(C(=O)OC(C)(C)C)CCCO5)[nH]c4c3)cc21

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 0.57
▸ KCNH2 Q12809 2/20 0.48

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
SCHEMBL31095786 0.96 CTSC (0.56) CTSCKCNH2
SCHEMBL25267517 0.90 CTSC (0.68) CTSCKCNH2
SCHEMBL16932289 0.90 CTSC (0.68) CTSCKCNH2
SCHEMBL31095589 0.90 CTSC (0.48) CTSCKCNH2
SCHEMBL31095688 0.89 CTSC (0.56) CTSCKCNH2
SCHEMBL31095639 0.89 CTSC (0.61) CTSCKCNH2
SCHEMBL30987108 0.88 CTSC (0.67) CTSCKCNH2
SCHEMBL31095684 0.88 CTSC (0.54) CTSCKCNH2
SCHEMBL31095575 0.88 CTSC (0.56) CTSCKCNH2
SCHEMBL31095609 0.87 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-4680247-A1 DPP1 INHIBITORS WITH POLYCYCLIC LINKERS AND USES THEREOF Insmed Incorporated (US) 2026-01-21 — — EP disclosed
WO-2024192416-A1 DPP1 INHIBITORS WITH POLYCYCLIC LINKERS AND USES THEREOF INSMED INCORPORATED (US) 2024-09-19 — — WO disclosed
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