SCHEMBL31757880

SCHEMBL31757880

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

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 19/20 0.54
▸ KCNH2 Q12809 1/20 0.44
▸ CTSK P43235 2/20 0.41
▸ CTSS P25774 1/20 0.41

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
SCHEMBL31758041 0.91 CTSC (0.52) CTSCKCNH2CTSKCTSS
SCHEMBL31757785 0.91 CTSC (0.52) CTSCKCNH2CTSKCTSS
SCHEMBL31757943 0.90 CTSC (0.57) CTSCCTSKCTSS
SCHEMBL16940311 0.89 CTSC (0.60) CTSCKCNH2CTSKCTSS
SCHEMBL20162066 0.89 CTSC (0.60) CTSCKCNH2CTSKCTSS
SCHEMBL30194946 0.89 CTSC (0.60) CTSCKCNH2CTSKCTSS
SCHEMBL31757753 0.89 CTSC (0.52) CTSCKCNH2CTSKCTSS
SCHEMBL31757915 0.89 CTSC (0.52) CTSCKCNH2CTSKCTSS
SCHEMBL31757826 0.88 CTSC (0.50) CTSCKCNH2CTSKCTSS
SCHEMBL31758060 0.88 CTSC (0.50) CTSCKCNH2CTSKCTSS

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260008758-A1 LINEAR DIPEPTIDYL PEPTIDASE 1 INHIBITORS AND USES THEREOF INSMED INCORPORATED 2026-01-08 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20260008758-A1 LINEAR DIPEPTIDYL PEPTIDASE 1 INHIBITORS AND USES THEREOF DPP3, DPP7, DPP9 CTSC 6/4885KCNH2 1357/4885CTSK 82/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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