SCHEMBL25016558

SCHEMBL25016558

N=C(N)c1ccc2cc(C(=O)N[C@H]3CC[C@H](N)CC3)n(Cc3cc(O)cc4ccccc34)c2c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 14/20 0.43
▸ F2 P00734 6/20 0.42
▸ PRSS1 P07477 6/20 0.42
▸ PRSS2 P07478 6/20 0.42
▸ PRSS3 P35030 6/20 0.42
▸ ST14 Q9Y5Y6 6/20 0.42
▸ SMYD3 Q9H7B4 1/20 0.39

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
SCHEMBL25016348 0.92 F10 (0.46) F10F2PRSS1PRSS2PRSS3
SCHEMBL30180633 0.92 F10 (0.46) F10F2PRSS1PRSS2PRSS3
SCHEMBL25017123 0.91 F10 (0.49) F10F2PRSS1PRSS2PRSS3
SCHEMBL25017106 0.91 F10 (0.49) F10F2PRSS1PRSS2PRSS3
SCHEMBL25017635 0.91 F10 (0.44) F10F2PRSS1PRSS2PRSS3
SCHEMBL30180713 0.90 F10 (0.44) F10F2PRSS1PRSS2PRSS3
SCHEMBL25017637 0.90 F10 (0.44) F10F2PRSS1PRSS2PRSS3
SCHEMBL25017510 0.89 F10 (0.42) F10F2PRSS1PRSS2PRSS3
SCHEMBL25015929 0.88 ST14 (0.53) F10F2PRSS1PRSS2PRSS3
SCHEMBL25015988 0.88 F10 (0.43) F10F2PRSS1PRSS2PRSS3

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-20230043159-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF DISC MEDICINE, INC. 2023-02-09 — — 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-20230043159-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF MMP7, MATR3, SPINT2 F10 1548/4885F2 408/4885PRSS1 39/4885

“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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