SCHEMBL31758739

SCHEMBL31758739

CO[C@H]1CCO[C@H](C(=O)N[C@H](C#N)Cc2ccc(-c3ccc4oc(=O)n(C)c4c3)s2)CNC1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 0.61
▸ KCNH2 Q12809 2/20 0.52

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
SCHEMBL31095816 0.91 CTSC (0.59) CTSCKCNH2
SCHEMBL31095663 0.91 CTSC (0.59) CTSCKCNH2
SCHEMBL31095789 0.91 CTSC (0.59) CTSCKCNH2
SCHEMBL31095797 0.91 CTSC (0.59) CTSCKCNH2
SCHEMBL30987114 0.89 CTSC (0.77) CTSCKCNH2
SCHEMBL30987162 0.89 CTSC (0.77) CTSCKCNH2
SCHEMBL30987192 0.89 CTSC (0.77) CTSCKCNH2
SCHEMBL30987050 0.89 CTSC (0.77) CTSCKCNH2
SCHEMBL25146333 0.88 CTSC (0.78) CTSCKCNH2
SCHEMBL24981553 0.88 CTSC (0.78) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260008760-A1 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-20260008760-A1 DIPEPTIDYL PEPTIDASE 1 INHIBITORS AND USES THEREOF DPP9, DPP7, DPP4 CTSC 6/4885KCNH2 1384/4885

“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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