SCHEMBL2265343

SCHEMBL2265343

O=C1Nc2ccccc2Nc2nnccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 9/20 1.00
CDK2 P24941 8/20 1.00
CDK5 Q00535 5/20 1.00
GSK3A P49840 4/20 1.00
PLK4 O00444 3/20 1.00
AURKA O14965 3/20 1.00
CHEK2 O96017 3/20 1.00
CSNK1D P48730 3/20 1.00
AURKB Q96GD4 3/20 1.00
STK3 Q13188 2/20 1.00
LCK P06239 2/20 1.00
MAPK8 P45983 2/20 1.00
BLK P51451 1/20 1.00
CYP1A2 P05177 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
MAP4K4 O95819 6/20 0.57
CLK4 Q9HAZ1 6/20 0.57
KDR P35968 3/20 0.57
HIPK2 Q9H2X6 3/20 0.57
CDK1 P06493 2/20 0.57

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
SCHEMBL5937366 0.76 CYP1A2 (1.00) GSK3BCDK2CDK5GSK3APLK4
SCHEMBL2261826 0.72 GSK3B (0.67) GSK3BCDK2CDK5GSK3APLK4
SCHEMBL2264395 0.72 GSK3B (1.00) GSK3BCDK2CDK5GSK3APLK4
SCHEMBL2260312 0.72 GSK3B (1.00) GSK3BCDK2CDK5GSK3APLK4
SCHEMBL12367158 0.72 GSK3B (0.56) GSK3BCDK2CDK5GSK3APLK4
SCHEMBL477913 0.72 CDK2 (0.56) GSK3BCDK2CDK5GSK3APLK4
SCHEMBL11528200 0.70 CYP1A2 (0.56) GSK3BCDK2CDK5GSK3APLK4
SCHEMBL2259464 0.69 GSK3B (0.61) GSK3BCDK2CDK5GSK3APLK4
SCHEMBL2262358 0.69 GSK3B (0.61) GSK3BCDK2CDK5GSK3APLK4
SCHEMBL5697347 0.68 ACVR1 (0.67) GSK3BCDK2CDK5GSK3APLK4

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
US-7994160-B2 Pyridazine compounds as glycogen synthase kinase 3 inhibitors ABBOTT GMBH & CO. KG (DE) 2011-08-09 US claimed
US-20090325937-A1 Pyridazine Compounds as Glycogen Synthase Kinase 3 Inhibitors ABBOTT GMBH & CO. KG (DE) 2009-12-31 US claimed
EP-1902055-A1 PYRIDAZINE COMPOUNDS AS GLYCOGEN SYNTHASE KINASE 3 INHIBITORS Abbott GmbH & Co. KG (DE) 2008-03-26 EP claimed
WO-2007006566-A1 PYRIDAZINE COMPOUNDS AS GLYCOGEN SYNTHASE KINASE 3 INHIBITORS ABBOTT GMBH & CO. KG (DE) 2007-01-18 WO claimed
US-7994160-B2 Pyridazine compounds as glycogen synthase kinase 3 inhibitors ABBOTT GMBH & CO. KG (DE) 2011-08-09 US disclosed
US-7994160-B2 Pyridazine compounds as glycogen synthase kinase 3 inhibitors ABBOTT GMBH & CO. KG (DE) 2011-08-09 US disclosed
US-20090325937-A1 Pyridazine Compounds as Glycogen Synthase Kinase 3 Inhibitors ABBOTT GMBH & CO. KG (DE) 2009-12-31 US disclosed
US-20090325937-A1 Pyridazine Compounds as Glycogen Synthase Kinase 3 Inhibitors ABBOTT GMBH & CO. KG (DE) 2009-12-31 US disclosed
EP-1902055-A1 PYRIDAZINE COMPOUNDS AS GLYCOGEN SYNTHASE KINASE 3 INHIBITORS Abbott GmbH & Co. KG (DE) 2008-03-26 EP disclosed
WO-2007006566-A1 PYRIDAZINE COMPOUNDS AS GLYCOGEN SYNTHASE KINASE 3 INHIBITORS ABBOTT GMBH & CO. KG (DE) 2007-01-18 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-20090325937-A1 Pyridazine Compounds as Glycogen Synthase Kinase 3 Inhibitors GSK3B, GSK3A, GYS2 GSK3B 1/4885CDK2 32/4885CDK5 97/4885

“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.