SCHEMBL477058

SCHEMBL477058

Cc1nc2ccc(N3CC(C)NC(C)C3)nn2c1-c1ccncc1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 11/20 0.67
RIPK3 Q9Y572 7/20 0.43
CLK2 P49760 1/20 0.39
DYRK1A Q13627 1/20 0.39
HASPIN Q8TF76 1/20 0.39
MAPK13 O15264 1/20 0.38
MAPK12 P53778 1/20 0.38
MAPK11 Q15759 1/20 0.38
MAPK14 Q16539 1/20 0.38

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
SCHEMBL477056 1.00 CSNK1E (0.67) CSNK1ERIPK3CLK2DYRK1AHASPIN
SCHEMBL476995 0.87 CSNK1E (0.74) CSNK1ERIPK3MAPK13MAPK12MAPK11
SCHEMBL477069 0.87 CSNK1E (0.52) CSNK1ERIPK3CLK2DYRK1AHASPIN
SCHEMBL477071 0.87 CSNK1E (0.52) CSNK1ERIPK3CLK2DYRK1AHASPIN
SCHEMBL477170 0.87 CSNK1E (0.74) CSNK1ERIPK3MAPK13MAPK12MAPK11
SCHEMBL476996 0.87 CSNK1E (0.74) CSNK1ERIPK3MAPK13MAPK12MAPK11
SCHEMBL477049 0.85 CSNK1E (0.54) CSNK1ERIPK3MAPK13MAPK12MAPK11
SCHEMBL477048 0.85 CSNK1E (0.54) CSNK1ERIPK3MAPK13MAPK12MAPK11
SCHEMBL477112 0.85 CSNK1E (0.69) CSNK1ERIPK3CLK2DYRK1AHASPIN
SCHEMBL477052 0.85 CSNK1E (0.49) CSNK1ERIPK3CLK2DYRK1AHASPIN

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
EP-2331546-B1 2-ALKYL-6-CYCLOAMINO-3-(PYRIDIN-4-YL)IMIDAZO[1,2-IB]-PYRIDAZINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF SANOFI SA (FR) 2012-02-01 EP claimed
US-20110312934-A1 2-ALKYL-6-CYCLOAMINO-3-(PYRIDIN-4-YL)IMIDAZO[1,2-B]-PYRIDAZINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2011-12-22 US claimed
EP-2331546-B1 2-ALKYL-6-CYCLOAMINO-3-(PYRIDIN-4-YL)IMIDAZO[1,2-IB]-PYRIDAZINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF SANOFI SA (FR) 2012-02-01 EP disclosed
US-20110312934-A1 2-ALKYL-6-CYCLOAMINO-3-(PYRIDIN-4-YL)IMIDAZO[1,2-B]-PYRIDAZINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2011-12-22 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-20110312934-A1 2-ALKYL-6-CYCLOAMINO-3-(PYRIDIN-4-YL)IMIDAZO[1,2-B]-PYRIDAZINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF NR3C1, CNKSR1, NR3C2 CSNK1E 2760/4885RIPK3 4284/4885CLK2 3947/4885

“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.