Pyrazolopyridazine 1

Pyrazolopyridazine 1

SCHEMBL4489357

COc1cccc(Nc2nccc(-c3cnn4ncccc34)n2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 16/20 1.00
GSK3B P49841 14/20 1.00
CDK4 P11802 13/20 1.00
DYRK1A Q13627 5/20 1.00
SLC2A1 P11166 2/20 0.66

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
Gw801372X SCHEMBL4472952 0.92 CDK2 (1.00) CDK2GSK3BCDK4DYRK1A
SCHEMBL6206049 0.90 CDK2 (0.81) CDK2GSK3BCDK4DYRK1ASLC2A1
SCHEMBL4478725 0.88 CDK2 (0.82) CDK2GSK3BCDK4DYRK1A
SCHEMBL4475408 0.84 CDK2 (1.00) CDK2GSK3BCDK4DYRK1A
SCHEMBL4471746 0.83 CDK2 (0.81) CDK2GSK3BCDK4DYRK1A
SCHEMBL4484286 0.83 CDK2 (1.00) CDK2GSK3BCDK4DYRK1A
SCHEMBL4488333 0.82 CDK2 (1.00) CDK2GSK3BCDK4DYRK1A
SCHEMBL13713471 0.82 DYRK1A (0.75) CDK2GSK3BCDK4DYRK1ASLC2A1
SCHEMBL4479694 0.81 CDK2 (0.77) CDK2GSK3BCDK4DYRK1ASLC2A1
Gw778894X SCHEMBL29636882 0.81 CDK2 (1.00) CDK2GSK3BCDK4DYRK1ASLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7279473-B2 Pyrazolopyridazine derivatives SMITHKLINE BEECHAM CORPORATION (US) 2007-10-09 US claimed
EP-1463730-B1 PYRAZOLOPYRIDAZINE DERIVATIVES SMITHKLINE BEECHAM CORP (US) 2006-04-19 EP claimed
US-20060069097-A1 Pyradazine compounds as gsk-3 inhibitors SMITHKLINE BEECHAM CORPORATION 2006-03-30 US claimed
EP-1551842-A1 PYRADAZINE COMPOUNDS AS GSK-3 INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2005-07-13 EP claimed
US-20050090507-A1 Pyrazolopyridazine derivatves SMITHKLINE BEECHAM CORPORATION 2005-04-28 US claimed
WO-2004035588-A1 PYRADAZINE COMPOUNDS AS GSK-3 INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-04-29 WO claimed
US-11596631-B2 CDK12 inhibitors and their uses THE UNIVERSITY OF NOTTINGHAM (GB) 2023-03-07 US disclosed
US-20190038625-A1 INHIBITORS AND THEIR USES THE UNIVERSITY OF NOTTINGHAM (GB) 2019-02-07 US disclosed
US-7582630-B2 Pyradazine compounds as GSK-3 inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2009-09-01 US disclosed
US-7582630-B2 Pyradazine compounds as GSK-3 inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2009-09-01 US disclosed
US-7582630-B2 Pyradazine compounds as GSK-3 inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2009-09-01 US disclosed
US-7279473-B2 Pyrazolopyridazine derivatives SMITHKLINE BEECHAM CORPORATION (US) 2007-10-09 US disclosed
US-7279473-B2 Pyrazolopyridazine derivatives SMITHKLINE BEECHAM CORPORATION (US) 2007-10-09 US disclosed
US-7279473-B2 Pyrazolopyridazine derivatives SMITHKLINE BEECHAM CORPORATION (US) 2007-10-09 US disclosed
EP-1463730-B1 PYRAZOLOPYRIDAZINE DERIVATIVES SMITHKLINE BEECHAM CORP (US) 2006-04-19 EP disclosed
US-20060069097-A1 Pyradazine compounds as gsk-3 inhibitors SMITHKLINE BEECHAM CORPORATION 2006-03-30 US disclosed
US-20050090507-A1 Pyrazolopyridazine derivatves SMITHKLINE BEECHAM CORPORATION 2005-04-28 US disclosed
EP-1463730-A1 PYRAZOLOPARIDAZINE DERIVATIVES SmithKline Beecham Corporation (US) 2004-10-06 EP disclosed
WO-2004035588-A1 PYRADAZINE COMPOUNDS AS GSK-3 INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-04-29 WO disclosed
WO-2003051886-A1 PYRAZOLOPYRIDAZINE DERIVATIVES SMITHKLINE BEECHAM CORPORATION (US) 2003-06-26 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 (4 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-20050090507-A1 Pyrazolopyridazine derivatves CDK4, CDK3, CDK8 CDK2 8/4885GSK3B 1622/4885CDK4 1/4885
US-11596631-B2 CDK12 inhibitors and their uses CDK12, CDK1, CDK17 CDK2 13/4885GSK3B 320/4885CDK4 33/4885
US-20190038625-A1 INHIBITORS AND THEIR USES CDK12, CDK1, CDK17 CDK2 12/4885GSK3B 314/4885CDK4 30/4885
US-20060069097-A1 Pyradazine compounds as gsk-3 inhibitors GSK3B, GSK3A, GSKIP CDK2 91/4885GSK3B 1/4885CDK4 218/4885

“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.