SCHEMBL477082

SCHEMBL477082

Cc1nc2ccc(N3C[C@@H]4CCCN[C@H]4C3)nn2c1-c1ccncc1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 11/20 0.61
HRH4 Q9H3N8 2/20 0.42
RIPK3 Q9Y572 5/20 0.40
HTR3A P46098 1/20 0.36

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
SCHEMBL477081 1.00 CSNK1E (0.61) CSNK1EHRH4RIPK3HTR3A
SCHEMBL477083 1.00 CSNK1E (0.61) CSNK1EHRH4RIPK3HTR3A
SCHEMBL3114648 0.85 CSNK1E (0.65) CSNK1EHRH4RIPK3
SCHEMBL3121838 0.85 CSNK1E (0.65) CSNK1EHRH4RIPK3
SCHEMBL3108559 0.85 CSNK1E (0.65) CSNK1EHRH4RIPK3
SCHEMBL3116720 0.84 CSNK1E (0.66) CSNK1EHRH4RIPK3
SCHEMBL3112002 0.84 CSNK1E (0.66) CSNK1EHRH4RIPK3
SCHEMBL477021 0.83 CSNK1E (0.49) CSNK1EHRH4RIPK3
SCHEMBL477020 0.83 CSNK1E (0.49) CSNK1EHRH4RIPK3
SCHEMBL477018 0.83 CSNK1E (0.49) CSNK1EHRH4RIPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 2760/4885HRH4 10/4885RIPK3 4284/4885

“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.