SCHEMBL3247346

SCHEMBL3247346

FC(F)(F)c1cccc(Nc2nccc(-c3cnc4[nH]ccc4c3)n2)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.59
CLK2 P49760 1/20 0.59
DYRK1A Q13627 1/20 0.59
CLK4 Q9HAZ1 1/20 0.59
DYRK1B Q9Y463 1/20 0.59
AURKA O14965 3/20 0.56
MTOR P42345 1/20 0.56
SMG1 Q96Q15 1/20 0.56
GSK3B P49841 8/20 0.52
CDK2 P24941 5/20 0.52
CDK4 P11802 1/20 0.50
CDK8 P49336 2/20 0.48
FLT1 P17948 1/20 0.47
FLT4 P35916 1/20 0.47
KDR P35968 1/20 0.47
KDM4E B2RXH2 1/20 0.46
CTSC P53634 1/20 0.46
IDH2 P48735 1/20 0.46

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
SCHEMBL27115591 0.87 CDK2 (0.55) CDK2CDK4CDK8
SCHEMBL27115341 0.86 CLK1 (0.63) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL27118924 0.85 CLK1 (0.57) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL27115595 0.84 CLK1 (0.66) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL3246045 0.84 PIK3CG (0.52) AURKACDK8KDR
SCHEMBL3252954 0.84 ABL1 (0.64) MTORSMG1CDK2CDK4CDK8
SCHEMBL20998475 0.84 PLK1 (0.57) CDK8
SCHEMBL27119203 0.82 AURKA (0.63) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL27115447 0.81 CLK1 (0.57) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL3247348 0.81 AURKA (0.58) CLK1CLK2DYRK1ACLK4DYRK1B

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-1896470-B1 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-05-26 EP claimed
US-20080300267-A1 Compounds and Compositions as Protein Kinase Inhibitors TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-12-04 US claimed
EP-1896470-A2 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2008-03-12 EP claimed
WO-2006124863-A2 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-11-23 WO claimed
EP-1896470-B1 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-05-26 EP disclosed
EP-1896470-B1 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-05-26 EP disclosed
US-20080300267-A1 Compounds and Compositions as Protein Kinase Inhibitors TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-12-04 US disclosed
US-20080300267-A1 Compounds and Compositions as Protein Kinase Inhibitors TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-12-04 US disclosed
US-20080300267-A1 Compounds and Compositions as Protein Kinase Inhibitors TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-12-04 US disclosed
EP-1896470-A2 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2008-03-12 EP disclosed
WO-2006124863-A2 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-11-23 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-20080300267-A1 Compounds and Compositions as Protein Kinase Inhibitors ERBB2, JAK2, AURKC CLK1 1000/4885CLK2 411/4885DYRK1A 310/4885

“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.