SCHEMBL14059404

SCHEMBL14059404

COC(=O)c1ccc(-c2cnc(N)c(C(=O)Nc3ccncc3)c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TBK1 Q9UHD2 19/20 1.00
▸ IKBKE Q14164 17/20 1.00
▸ PRKCI P41743 1/20 0.71

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
SCHEMBL14059588 0.89 TBK1 (0.80) TBK1IKBKEPRKCI
SCHEMBL14059258 0.88 TBK1 (0.80) TBK1IKBKEPRKCI
SCHEMBL14061575 0.87 TBK1 (0.82) TBK1IKBKEPRKCI
SCHEMBL14059865 0.87 TBK1 (1.00) TBK1IKBKEPRKCI
SCHEMBL14061479 0.86 PRKCI (0.81) TBK1IKBKEPRKCI
SCHEMBL14059119 0.85 TBK1 (0.74) TBK1IKBKEPRKCI
SCHEMBL14059115 0.85 TBK1 (0.74) TBK1IKBKEPRKCI
SCHEMBL14061657 0.84 PRKCI (0.79) TBK1IKBKEPRKCI
SCHEMBL14059524 0.84 TBK1 (0.71) TBK1IKBKEPRKCI
SCHEMBL14059120 0.84 TBK1 (0.71) TBK1IKBKEPRKCI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2714677-B1 PYRIDINE-AND PYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2018-08-22 — — EP claimed
WO-2012161877-A1 PYRIDINE-AND PYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-11-29 — — WO claimed
EP-2714677-B1 PYRIDINE-AND PYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2018-08-22 — — EP disclosed
US-9273029-B2 Pyridine-and pyrazine derivatives MERCK PATENT GMBH (DE) 2016-03-01 — — US disclosed
US-9273029-B2 Pyridine-and pyrazine derivatives MERCK PATENT GMBH (DE) 2016-03-01 — — US disclosed
US-9273029-B2 Pyridine-and pyrazine derivatives MERCK PATENT GMBH (DE) 2016-03-01 — — US disclosed
US-20140142097-A1 PYRIDINE-AND PYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2014-05-22 — — US disclosed
US-20140142097-A1 PYRIDINE-AND PYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2014-05-22 — — US disclosed
US-20140142097-A1 PYRIDINE-AND PYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2014-05-22 — — US disclosed
WO-2012161877-A1 PYRIDINE-AND PYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-11-29 — — WO disclosed
WO-2012161877-A1 PYRIDINE-AND PYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-11-29 — — 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 (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-20140142097-A1 PYRIDINE-AND PYRAZINE DERIVATIVES TBK1, IRAK1, IRAK2 TBK1 1/4885IKBKE 11/4885PRKCI 45/4885

“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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