SCHEMBL16068634

SCHEMBL16068634

Nc1[nH]nc(C2CCOCC2)c1F

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PRKAB2 O43741 1/20 0.32
▸ PRKAG1 P54619 1/20 0.32
▸ PRKAA2 P54646 1/20 0.32
▸ PRKAA1 Q13131 1/20 0.32
▸ PRKAG3 Q9UGI9 1/20 0.32
▸ PRKAG2 Q9UGJ0 1/20 0.32
▸ PRKAB1 Q9Y478 1/20 0.32

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
SCHEMBL17522838 0.80 — —
SCHEMBL21877671 0.77 FFAR2 (0.34) —
SCHEMBL21877623 0.76 JAK2 (0.33) —
SCHEMBL21877621 0.76 JAK2 (0.33) —
SCHEMBL16102245 0.71 HCAR2 (0.41) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL31278050 0.66 PRKACA (0.39) —
SCHEMBL1559055 0.66 IRAK4 (0.33) —
SCHEMBL15555744 0.66 — —
SCHEMBL29190706 0.65 AXL (0.41) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL30833630 0.65 AXL (0.41) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3

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 12 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 disclosed
US-20180186751-A1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN VERSEON INTERNATIONAL CORPORATION 2018-07-05 — — US disclosed
US-20180186751-A1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN VERSEON INTERNATIONAL CORPORATION 2018-07-05 — — US 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-9951025-B2 Halogenopyrazoles as inhibitors of thrombin VERSEON CORPORATION (US) 2018-04-24 — — 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
US-20160046585-A1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN VERSEON INTERNATIONAL CORPORATION 2016-02-18 — — US disclosed
US-20160046585-A1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN VERSEON INTERNATIONAL CORPORATION 2016-02-18 — — US disclosed
WO-2014149139-A2 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN VERSEON, INC. (US) 2014-09-25 — — WO disclosed
WO-2014146059-A1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN VERSEON, INC. (US) 2014-09-18 — — WO 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 PRKAB2 3199/4885PRKAG1 2455/4885PRKAA2 2452/4885
US-20160046585-A1 HALOGENOPYRAZOLES AS INHIBITORS OF THROMBIN F2, TFPI, SERPINC1 PRKAB2 3199/4885PRKAG1 2455/4885PRKAA2 2452/4885

“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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