SCHEMBL17696324

SCHEMBL17696324

Cc1cnn(Cc2ccc(Cc3nc(C)c(C(=O)NCc4ccc5c(N)nccc5c4)s3)cc2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 20/20 1.00
▸ KLK1 P06870 6/20 0.72

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
SCHEMBL18725226 0.87 KLKB1 (0.77) KLKB1KLK1
SCHEMBL29388225 0.84 KLKB1 (1.00) KLKB1KLK1
SCHEMBL16486517 0.84 KLKB1 (1.00) KLKB1KLK1
SCHEMBL17696322 0.83 KLKB1 (1.00) KLKB1
SCHEMBL16486444 0.82 KLKB1 (1.00) KLKB1KLK1
SCHEMBL16486859 0.82 KLKB1 (1.00) KLKB1KLK1
SCHEMBL17818602 0.82 KLKB1 (0.75) KLKB1KLK1
SCHEMBL16486958 0.82 KLKB1 (1.00) KLKB1KLK1
SCHEMBL16487444 0.82 KLKB1 (1.00) KLKB1KLK1
SCHEMBL16260544 0.81 KLKB1 (1.00) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160108036-A1 HETEROCYCLIC DERIVATES KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-04-21 — — 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-20160108036-A1 HETEROCYCLIC DERIVATES BDKRB1, KLKB1, BDKRB2 KLKB1 2/4885KLK1 7/4885

“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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