SCHEMBL13859351

SCHEMBL13859351

COc1ccc(NC(=O)/C(C#N)=C\C2CC2)cc1Nc1nccc(-c2ccccc2)n1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PRKCA P17252 3/20 0.57
▸ CAMKK2 Q96RR4 4/20 0.52
▸ PIK3CG P48736 3/20 0.52
▸ MAPK8 P45983 3/20 0.48
▸ EGFR P00533 5/20 0.47
▸ ABL1 P00519 10/20 0.47
▸ BCR P11274 10/20 0.47
▸ PDGFRB P09619 2/20 0.47
▸ PDGFRA P16234 2/20 0.47
▸ JAK3 P52333 1/20 0.44
▸ GSK3B P49841 1/20 0.43

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
SCHEMBL13859353 1.00 PRKCA (0.57) PRKCACAMKK2PIK3CGMAPK8EGFR
SCHEMBL13859343 0.89 EGFR (0.49) PRKCAEGFRJAK3
SCHEMBL13859342 0.89 EGFR (0.49) PRKCAEGFRJAK3
SCHEMBL13859531 0.87 EGFR (0.51) PRKCAEGFRJAK3
SCHEMBL13859529 0.87 EGFR (0.51) PRKCAEGFRJAK3
SCHEMBL13859470 0.87 EGFR (0.47) PRKCACAMKK2PIK3CGMAPK8EGFR
SCHEMBL13859468 0.87 EGFR (0.47) PRKCACAMKK2PIK3CGMAPK8EGFR
SCHEMBL13859249 0.85 EGFR (0.49) PRKCACAMKK2PIK3CGMAPK8EGFR
SCHEMBL13859251 0.85 EGFR (0.49) PRKCACAMKK2PIK3CGMAPK8EGFR
SCHEMBL13859349 0.85 ABL1 (0.52) PRKCACAMKK2PIK3CGMAPK8ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9580427-B2 Kinase inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-02-28 — — US disclosed
US-20140323464-A1 KINASE INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-10-30 — — US disclosed
EP-2710007-A2 KINASE INHIBITORS The Regents of the University of California (US) 2014-03-26 — — EP disclosed
WO-2012158843-A2 KINASE INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-11-22 — — 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-20140323464-A1 KINASE INHIBITORS MAP3K20, MAP3K19, MAP3K1 PRKCA 82/4885CAMKK2 237/4885PIK3CG 270/4885

“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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