SCHEMBL21822277

SCHEMBL21822277

CCOC(=O)c1ccc(Cn2c(C(=O)N[C@H]3CC[C@H](N)CC3)cc3ccc(C(=N)N)cc32)cc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 10/20 0.55
▸ PRSS1 P07477 11/20 0.51
▸ F2 P00734 10/20 0.51
▸ ST14 Q9Y5Y6 8/20 0.47
▸ PRSS2 P07478 7/20 0.47
▸ PRSS3 P35030 7/20 0.47
▸ SMYD3 Q9H7B4 1/20 0.42
▸ NOD2 Q9HC29 1/20 0.42
▸ NOD1 Q9Y239 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ PLG P00747 1/20 0.42

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
SCHEMBL21822370 0.92 F2 (0.51) F10PRSS1F2ST14PRSS2
SCHEMBL32665959 0.92 F2 (0.51) F10PRSS1F2ST14PRSS2
SCHEMBL25015989 0.89 F2 (0.50) F10PRSS1F2ST14PRSS2
SCHEMBL31689657 0.88 F2 (0.48) F10PRSS1F2ST14PRSS2
SCHEMBL25016626 0.88 F2 (0.48) F10PRSS1F2ST14PRSS2
SCHEMBL25015887 0.88 ST14 (0.51) F10PRSS1F2ST14PRSS2
SCHEMBL28573811 0.87 MAPT (0.47) F10PRSS1F2SMYD3NOD2
SCHEMBL28573808 0.87 MAPT (0.47) F10PRSS1F2SMYD3NOD2
SCHEMBL31689670 0.87 F10 (0.45) F10PRSS1F2ST14PRSS2
SCHEMBL28572148 0.87 F10 (0.45) F10PRSS1F2ST14PRSS2

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
US-20230043159-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF DISC MEDICINE, INC. 2023-02-09 — — US disclosed
EP-3860636-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF Disc Medicine, Inc. (US) 2021-08-11 — — EP disclosed
WO-2020072580-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF DISC MEDICINE, INC. (US) 2020-04-09 — — WO 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 1548/4885PRSS1 39/4885F2 408/4885

“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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