SCHEMBL10224971

SCHEMBL10224971

Cc1nc2ccc(N3CCC4(CC3)CN(C(=O)OC(C)(C)C)CCO4)nn2c1-c1ccncc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 5/20 0.50
HASPIN Q8TF76 1/20 0.42
EIF2AK4 Q9P2K8 1/20 0.39
SMPD3 Q9NY59 2/20 0.38
CYP11B2 P19099 1/20 0.36
RIPK3 Q9Y572 5/20 0.36
NAMPT P43490 2/20 0.36
GPR119 Q8TDV5 3/20 0.35

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
SCHEMBL477139 0.76 CSNK1E (0.67) CSNK1ERIPK3
Hydrochloric Acid SCHEMBL16495834 0.75 CSNK1E (0.66) CSNK1ERIPK3
SCHEMBL20025052 0.70 CYP3A4 (0.49) EIF2AK4NAMPTGPR119
SCHEMBL13350667 0.70 RIPK3 (0.62) CSNK1EHASPINRIPK3GPR119
SCHEMBL29579532 0.68 USP2 (0.56) EIF2AK4CYP11B2NAMPT
SCHEMBL477045 0.68 CSNK1E (1.00) CSNK1EHASPINRIPK3
SCHEMBL30644284 0.68 GPR119 (0.45) CYP11B2NAMPTGPR119
SCHEMBL14206389 0.67 CYP11B2 (0.45) CYP11B2GPR119
SCHEMBL20046097 0.67 GPR119 (0.49) CYP11B2NAMPTGPR119
SCHEMBL23410277 0.67 PTGS2 (0.48) GPR119

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 5 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 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
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
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
WO-2010018327-A1 2-ALKYL-6-CYCLOAMINO-3-(PYRIDIN-4-YL)IMIDAZO[1,2-IB]-PYRIDAZINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2010-02-18 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-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 2760/4885HASPIN 4266/4885EIF2AK4 2695/4885

“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.