SCHEMBL15901058

SCHEMBL15901058

CCC(=O)NC(CC1CCCCC1)C(=O)N[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(CN)cc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 15/20 0.58
▸ KLK1 P06870 6/20 0.51
▸ CPB2 Q96IY4 2/20 0.51
▸ MMP1 P03956 2/20 0.47
▸ FCER2 P06734 2/20 0.47
▸ F2R P25116 1/20 0.47

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
SCHEMBL14485573 1.00 KLKB1 (0.58) KLKB1KLK1CPB2MMP1FCER2
SCHEMBL14485454 0.88 KLKB1 (0.73) KLKB1KLK1MMP1FCER2
SCHEMBL14485458 0.88 KLKB1 (0.73) KLKB1KLK1MMP1FCER2
SCHEMBL14485428 0.88 KLKB1 (0.56) KLKB1KLK1CPB2MMP1FCER2
SCHEMBL15901636 0.88 KLKB1 (0.56) KLKB1KLK1CPB2MMP1FCER2
SCHEMBL14485377 0.83 KLKB1 (0.74) KLKB1KLK1
SCHEMBL14485384 0.83 KLKB1 (0.74) KLKB1KLK1
SCHEMBL17268029 0.81 KLKB1 (0.55) KLKB1KLK1
SCHEMBL17268030 0.81 KLKB1 (0.55) KLKB1KLK1
SCHEMBL15901415 0.81 KLKB1 (0.49) KLKB1KLK1CPB2MMP1FCER2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2729443-B3 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LTD (GB) 2020-02-12 — — EP disclosed
US-9234000-B2 Benzylamine derivatives as inhibitors of plasma kallikrein KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-01-12 — — US disclosed
EP-2729443-B1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LTD (GB) 2015-11-25 — — EP disclosed
US-20150225450-A1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LTD (GB) 2015-08-13 — — US 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 (2 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-20150225450-A1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KLKB1, KLK1, BDKRB1 KLKB1 1/4885KLK1 2/4885CPB2 46/4885
US-20140213611-A1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KLKB1, KLK1, BDKRB1 KLKB1 1/4885KLK1 2/4885CPB2 46/4885

“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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