SCHEMBL17525292

SCHEMBL17525292

CC(C)(C)C(=O)n1nc(C2CCOCC2)c(F)c1NCc1ccc(Cl)s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 17/20 1.00
▸ KLKB1 P03952 6/20 0.85

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
SCHEMBL20506379 0.92 F2 (1.00) F2KLKB1
SCHEMBL20506460 0.90 F2 (1.00) F2KLKB1
SCHEMBL21748336 0.90 F2 (0.83) F2KLKB1
SCHEMBL21748366 0.85 F2 (0.75) F2KLKB1
SCHEMBL21748335 0.84 KLKB1 (0.79) F2KLKB1
SCHEMBL21748358 0.84 F2 (0.72) F2KLKB1
SCHEMBL20506217 0.82 F2 (1.00) F2KLKB1
SCHEMBL20506168 0.82 KLKB1 (1.00) F2KLKB1
SCHEMBL21748370 0.82 KLKB1 (0.76) F2KLKB1
SCHEMBL29905859 0.82 F2 (0.69) F2KLKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970141-B1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN VERSEON CORP (US) 2020-02-26 — — EP claimed
US-9951025-B2 Halogenopyrazoles as inhibitors of thrombin VERSEON CORPORATION (US) 2018-04-24 — — US claimed
EP-3261639-B1 SUBSTITUTED PYRAZOLE COMPOUNDS AS SERINE PROTEASE INHIBITORS VERSEON INT CORPORATION (US) 2022-08-24 — — EP disclosed
EP-2970141-B1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN VERSEON CORP (US) 2020-02-26 — — EP disclosed
EP-2970141-B1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN VERSEON CORP (US) 2020-02-26 — — EP disclosed
US-20180186751-A1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN VERSEON INTERNATIONAL CORPORATION 2018-07-05 — — US disclosed
US-9951025-B2 Halogenopyrazoles as inhibitors of thrombin VERSEON CORPORATION (US) 2018-04-24 — — US disclosed
US-20160046585-A1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN VERSEON INTERNATIONAL CORPORATION 2016-02-18 — — 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-20180186751-A1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN F2, TFPI, SERPINC1 F2 1/4885KLKB1 134/4885
US-20160046585-A1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN F2, TFPI, SERPINC1 F2 1/4885KLKB1 134/4885

“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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