SCHEMBL25017832

SCHEMBL25017832

N=C(N)c1ccc2cc(C(=O)N[C@H]3CC[C@H](N)CC3)n(CCCc3ccccc3)c2c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DRD4 P21917 4/20 0.48
▸ CNR2 P34972 1/20 0.47
▸ F2 P00734 7/20 0.47
▸ PRSS1 P07477 7/20 0.47
▸ PRSS2 P07478 7/20 0.47
▸ PRSS3 P35030 7/20 0.47
▸ ST14 Q9Y5Y6 7/20 0.47
▸ F10 P00742 5/20 0.45
▸ SMYD3 Q9H7B4 3/20 0.44
▸ ITGB3 P05106 1/20 0.44
▸ ITGA2B P08514 1/20 0.44

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
SCHEMBL25017829 0.95 F10 (0.49) DRD4CNR2F2PRSS1PRSS2
SCHEMBL25016038 0.88 CNR2 (0.47) DRD4CNR2F2PRSS1PRSS2
SCHEMBL25015905 0.87 F10 (0.49) DRD4CNR2F2PRSS1PRSS2
SCHEMBL25015685 0.86 ST14 (0.46) CNR2F2PRSS1PRSS2PRSS3
SCHEMBL25017120 0.84 CNR2 (0.46) CNR2F2PRSS1PRSS2PRSS3
SCHEMBL25017312 0.83 ST14 (0.49) DRD4F2PRSS1PRSS2PRSS3
SCHEMBL21822344 0.83 ST14 (0.55) DRD4CNR2F2PRSS1PRSS2
SCHEMBL25016626 0.83 F2 (0.48) F2PRSS1PRSS2PRSS3ST14
SCHEMBL31689657 0.83 F2 (0.48) F2PRSS1PRSS2PRSS3ST14
SCHEMBL21822118 0.82 DRD4 (0.55) DRD4CNR2F2PRSS1PRSS2

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 DRD4 4826/4885CNR2 4734/4885F2 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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