SCHEMBL15901767

SCHEMBL15901767

CCOc1ccc(C[C@@H](NC(=O)c2ccccn2)C(=O)N[C@@H](Cc2ccccc2)C(=O)NCc2ccc(CN)cc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 20/20 0.79
▸ KLK1 P06870 6/20 0.75

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
SCHEMBL15901511 0.92 KLKB1 (0.75) KLKB1KLK1
SCHEMBL15901477 0.90 KLKB1 (0.65) KLKB1KLK1
SCHEMBL15901589 0.89 KLKB1 (0.65) KLKB1KLK1
SCHEMBL15901497 0.89 KLKB1 (0.65) KLKB1KLK1
SCHEMBL23517198 0.88 KLKB1 (0.91) KLKB1KLK1
SCHEMBL14555079 0.88 KLKB1 (0.91) KLKB1KLK1
SCHEMBL21699873 0.88 KLKB1 (0.91) KLKB1KLK1
SCHEMBL17268102 0.88 KLKB1 (0.91) KLKB1KLK1
SCHEMBL14486227 0.88 KLKB1 (0.83) KLKB1KLK1
SCHEMBL20873692 0.88 KLKB1 (0.83) KLKB1KLK1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111032018-A Pharmaceutical composition 卡尔维斯塔制药有限公司 2020-04-17 — — CN claimed
US-20140213611-A1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LIMITED (GB) 2014-07-31 — — US claimed
CN-111032018-A Pharmaceutical composition 卡尔维斯塔制药有限公司 2020-04-17 — — CN disclosed
US-9051249-B2 Benzylamine derivatives as inhibitors of plasma kallikrein KALVISTA PHARMACEUTICALS LIMITED (GB) 2015-06-09 — — US disclosed
US-20140213611-A1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LIMITED (GB) 2014-07-31 — — 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-20140213611-A1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KLKB1, KLK1, BDKRB1 KLKB1 1/4885KLK1 2/4885

“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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