SCHEMBL2385591

SCHEMBL2385591

Cc1cccc(Nc2nc(Cl)ncc2C(N)=O)c1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 18/20 0.69
AURKB Q96GD4 4/20 0.65
KCNH2 Q12809 4/20 0.65
ZAP70 P43403 1/20 0.65
STAT6 P42226 2/20 0.59
MAPK3 P27361 2/20 0.59
MAPK1 P28482 2/20 0.59
GP6 Q9HCN6 1/20 0.59

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
SCHEMBL2386114 0.89 EGFR (0.56) SYKAURKBKCNH2ZAP70STAT6
SCHEMBL4716452 0.89 EGFR (0.56) SYKAURKBKCNH2ZAP70STAT6
SCHEMBL2627318 0.87 SYK (0.72) SYKAURKBKCNH2ZAP70STAT6
SCHEMBL2386728 0.86 STAT6 (0.59) SYKAURKBKCNH2ZAP70STAT6
SCHEMBL13624692 0.86 SYK (0.67) SYKAURKBKCNH2ZAP70STAT6
SCHEMBL2386416 0.84 SYK (0.70) SYKAURKBKCNH2ZAP70STAT6
SCHEMBL1313240 0.84 SYK (0.62) SYKAURKBKCNH2ZAP70MAPK3
SCHEMBL23196159 0.83 SYK (0.53) SYKAURKBKCNH2ZAP70MAPK1
SCHEMBL2386230 0.83 SYK (0.59) SYKAURKBKCNH2ZAP70MAPK1
SCHEMBL14659023 0.83 SYK (0.72) SYKAURKBKCNH2ZAP70STAT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110294749-A1 DIAMINOPYRIMIDINECARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2011-12-01 US disclosed
EP-1518855-B1 DIAMINOPYRIMIDINECARBOXA MIDE DERIVATIVE ASTELLAS PHARMA INC (JP) 2011-10-26 EP disclosed
US-8012959-B2 Diaminopyrimidinecarboxamide derivative ASTELLAS PHARMA INC. (JP) 2011-09-06 US disclosed
US-20090281072-A1 Diaminopyrimidinecarboxamide Derivative ASTELLAS PHARM INC. (JP) 2009-11-12 US disclosed
US-7449456-B2 Diaminopyrimidinecarboxamide derivative ASTELLAS PHARMA, INC. (JP) 2008-11-11 US disclosed
EP-1054004-B1 NOVEL PYRIMIDINE-5-CARBOXAMIDE DERIVATIVES ASTELLAS PHARMA INC (JP) 2008-07-16 EP disclosed
US-20050272753-A1 Diaminopyrimidinecarboxa mide derivative ASTELLAS PHARMA INC. (JP) 2005-12-08 US disclosed
EP-1518855-A1 DIAMINOPYRIMIDINECARBOXA MIDE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2005-03-30 EP disclosed
US-6432963-B1 ANTIINFLAMMATORY AGENTS; TYROSINE KINASE INHIBITOR YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2002-08-13 US disclosed
EP-1054004-A1 NOVEL PYRIMIDINE-5-CARBOXAMIDE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2000-11-22 EP 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 (3 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-20110294749-A1 DIAMINOPYRIMIDINECARBOXAMIDE DERIVATIVE STAT6, STAT4, STAT3 SYK 86/4885AURKB 1760/4885KCNH2 2791/4885
US-20050272753-A1 Diaminopyrimidinecarboxa mide derivative STAT5A, STAT6, STAT4 SYK 49/4885AURKB 1048/4885KCNH2 3164/4885
US-20090281072-A1 Diaminopyrimidinecarboxamide Derivative STAT6, STAT4, STAT3 SYK 86/4885AURKB 1760/4885KCNH2 2791/4885

“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.