SCHEMBL21726615

SCHEMBL21726615

CC(C)(C)[S+]([O-])NC(CCC1CC1)(c1cccc(C#N)c1)c1ccc(F)c(NC(=O)[C@H]2C[C@H](O)CN2C(=O)Nc2ccc(Cl)cc2)c1

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 15/20 0.79
▸ F10 P00742 4/20 0.44
▸ POLB P06746 1/20 0.37

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
SCHEMBL21726657 1.00 KLKB1 (0.79) KLKB1F10POLB
SCHEMBL21726656 1.00 KLKB1 (0.79) KLKB1F10POLB
SCHEMBL21726680 1.00 KLKB1 (0.79) KLKB1F10POLB
SCHEMBL22654263 1.00 KLKB1 (0.79) KLKB1F10POLB
SCHEMBL21726633 1.00 KLKB1 (0.79) KLKB1F10POLB
SCHEMBL22654307 1.00 KLKB1 (0.79) KLKB1F10POLB
SCHEMBL21726623 1.00 KLKB1 (0.79) KLKB1F10POLB
SCHEMBL21726688 1.00 KLKB1 (0.79) KLKB1F10POLB
SCHEMBL21726691 1.00 KLKB1 (0.79) KLKB1F10POLB
SCHEMBL31456855 1.00 KLKB1 (0.79) KLKB1F10POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11807605-B2 Human plasma kallikrein inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2023-11-07 — — US disclosed
EP-3355890-B1 HUMAN PLASMA KALLIKREIN INHIBITORS BIOCRYST PHARM INC (US) 2021-11-10 — — EP disclosed
US-10562850-B2 Human plasma kallikrein inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2020-02-18 — — 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-10562850-B2 Human plasma kallikrein inhibitors KLKB1, KLK5, KLK1 KLKB1 1/4885F10 109/4885POLB 4045/4885
US-11807605-B2 Human plasma kallikrein inhibitors KLKB1, KLK5, KLK1 KLKB1 1/4885F10 109/4885POLB 4045/4885

“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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