SCHEMBL2946441

SCHEMBL2946441

Nc1cccc(-c2cnc3ccc(NCc4cccc(Cl)c4)nn23)c1

nearest known ligand 0.83

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FYN P06241 10/20 0.83
DYRK3 O43781 3/20 0.60
CCNT1 O60563 3/20 0.60
CDK9 P50750 3/20 0.60
CDK5 Q00535 3/20 0.60
DYRK1A Q13627 3/20 0.60
CDK5R1 Q15078 3/20 0.60
DYRK2 Q92630 3/20 0.60
DYRK1B Q9Y463 3/20 0.60
CCNA2 P20248 2/20 0.60
CDK2 P24941 2/20 0.60
NTRK1 P04629 4/20 0.59
NTRK3 Q16288 4/20 0.59
NTRK2 Q16620 4/20 0.59
IKBKB O14920 1/20 0.56
MAPK10 P53779 1/20 0.56
MKNK1 Q9BUB5 1/20 0.54
PIM1 P11309 1/20 0.54

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
SCHEMBL18613504 0.91 FYN (1.00) FYNNTRK1NTRK3NTRK2IKBKB
SCHEMBL30521811 0.91 FYN (1.00) FYNNTRK1NTRK3NTRK2IKBKB
SCHEMBL16331653 0.89 FYN (0.66) FYNDYRK3CCNT1CDK9CDK5
SCHEMBL18613320 0.88 FYN (1.00) FYNDYRK3CCNT1CDK9CDK5
SCHEMBL30521744 0.88 FYN (1.00) FYNDYRK3CCNT1CDK9CDK5
SCHEMBL2945069 0.88 FYN (0.81) FYNDYRK3CCNT1CDK9CDK5
SCHEMBL2951009 0.86 FYN (0.74) FYNDYRK3DYRK1ADYRK2DYRK1B
SCHEMBL2943531 0.85 FYN (0.76) FYNDYRK3CCNT1CDK9CDK5
SCHEMBL2943785 0.85 FYN (0.79) FYNNTRK1NTRK3NTRK2IKBKB
SCHEMBL1055387 0.85 FYN (0.82) FYNNTRK1NTRK3NTRK2IKBKB

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
EP-1900739-A1 Diazolodiazine derivatives as kinase inhibitors CELLZOME AG (DE) 2008-03-19 EP claimed
WO-2008025822-A1 DIAZOLODIAZINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2008-03-06 WO claimed
US-7750000-B2 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER SCHERING PHARMA AG (DE) 2010-07-06 US disclosed
US-7750000-B2 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER SCHERING PHARMA AG (DE) 2010-07-06 US disclosed
US-7750000-B2 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER SCHERING PHARMA AG (DE) 2010-07-06 US disclosed
EP-1900739-A1 Diazolodiazine derivatives as kinase inhibitors CELLZOME AG (DE) 2008-03-19 EP disclosed
WO-2008025822-A1 DIAZOLODIAZINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2008-03-06 WO disclosed
US-20070093490-A1 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER INTELLECTUAL PROPERTY GMBH (DE) 2007-04-26 US disclosed
US-20070093490-A1 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER INTELLECTUAL PROPERTY GMBH (DE) 2007-04-26 US disclosed
US-20070093490-A1 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER INTELLECTUAL PROPERTY GMBH (DE) 2007-04-26 US 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-20070093490-A1 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments MAP4K2, MAP3K1, MAP3K2 FYN 421/4885DYRK3 539/4885CCNT1 773/4885

“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.