SCHEMBL25016778

SCHEMBL25016778

NCc1ccc2cc(C(=O)N[C@H]3CC[C@H](N)CC3)n(-c3ccc4ccccc4c3)c2c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PRSS1 P07477 2/20 0.46
▸ PRSS2 P07478 2/20 0.46
▸ PRSS3 P35030 2/20 0.46
▸ ST14 Q9Y5Y6 2/20 0.46
▸ F10 P00742 4/20 0.45
▸ SMYD3 Q9H7B4 5/20 0.43
▸ PDE4B Q07343 3/20 0.42
▸ MCHR1 Q99705 2/20 0.41
▸ F2 P00734 1/20 0.41
▸ TPSAB1 Q15661 1/20 0.41
▸ DRD4 P21917 2/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ SLC6A12 P48065 1/20 0.39
▸ SLC6A13 Q9NSD5 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
SCHEMBL25017933 0.83 ST14 (0.48) PRSS1PRSS2PRSS3ST14F10
SCHEMBL25017951 0.83 ST14 (0.48) PRSS1PRSS2PRSS3ST14F10
SCHEMBL25016018 0.78 HTR4 (0.46) TPSAB1
SCHEMBL25016195 0.77 F10 (0.45) PRSS1PRSS2PRSS3ST14F10
SCHEMBL25016287 0.77 F10 (0.45) PRSS1PRSS2PRSS3ST14F10
SCHEMBL25017917 0.74 ST14 (0.49) PRSS1PRSS2PRSS3ST14F10
SCHEMBL25016058 0.73 ST14 (0.41) PRSS1PRSS2PRSS3ST14F10
SCHEMBL21489902 0.72 CHRNA7 (0.56) SMYD3CNR2
SCHEMBL19701326 0.72 CHRNA7 (0.56) SMYD3CNR2
SCHEMBL25017145 0.70 F10 (0.46) F10F2DRD4CNR2

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 PRSS1 39/4885PRSS2 26/4885PRSS3 35/4885

“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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