SCHEMBL477052

SCHEMBL477052

Cc1nc2ccc(N3CC(C)NC(C)C3)nn2c1-c1ccnc(N)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 6/20 0.49
NMT1 P30419 1/20 0.39
EIF2AK4 Q9P2K8 1/20 0.35
KDR P35968 1/20 0.35
TGFBR1 P36897 1/20 0.35
PTPN11 Q06124 2/20 0.34
CLK2 P49760 1/20 0.34
DYRK1A Q13627 1/20 0.34
HASPIN Q8TF76 1/20 0.34
RIPK3 Q9Y572 3/20 0.33
MAP3K7 O43318 2/20 0.33
PIM1 P11309 1/20 0.33
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
HDAC1 Q13547 1/20 0.32

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
SCHEMBL477051 1.00 CSNK1E (0.49) CSNK1ENMT1EIF2AK4KDRTGFBR1
SCHEMBL477069 0.90 CSNK1E (0.52) CSNK1ENMT1EIF2AK4CLK2DYRK1A
SCHEMBL477071 0.90 CSNK1E (0.52) CSNK1ENMT1EIF2AK4CLK2DYRK1A
SCHEMBL477095 0.89 CSNK1E (0.56) CSNK1ENMT1
SCHEMBL477117 0.89 CSNK1E (0.56) CSNK1ENMT1
SCHEMBL477096 0.89 CSNK1E (0.56) CSNK1ENMT1
SCHEMBL477165 0.88 CSNK1E (0.47) CSNK1ENMT1EIF2AK4PTPN11CLK2
SCHEMBL477152 0.87 CSNK1E (0.41) CSNK1ENMT1EIF2AK4KDRTGFBR1
SCHEMBL477151 0.87 CSNK1E (0.41) CSNK1ENMT1EIF2AK4KDRTGFBR1
SCHEMBL477000 0.87 CSNK1E (0.51) CSNK1EKDRTGFBR1PTPN11CLK2

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 2760/4885NMT1 4192/4885EIF2AK4 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.