SCHEMBL14633393

SCHEMBL14633393

O=c1c2cnc(Nc3ccc(N4CCNCC4)cc3)nc2c(-c2ccncc2)nn1-c1c(F)cccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ WEE1 P30291 17/20 0.56
▸ CYP3A4 P08684 1/20 0.49
▸ KCNH2 Q12809 1/20 0.45
▸ CDK4 P11802 1/20 0.44
▸ CDK6 Q00534 1/20 0.44
▸ ACVR1 Q04771 1/20 0.44
▸ TNK2 Q07912 1/20 0.44

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
SCHEMBL14633119 0.91 WEE1 (0.60) WEE1CYP3A4KCNH2
SCHEMBL14633310 0.87 WEE1 (0.60) WEE1CYP3A4KCNH2CDK4
SCHEMBL14633445 0.86 WEE1 (0.64) WEE1CYP3A4KCNH2
SCHEMBL14633067 0.85 WEE1 (0.58) WEE1CYP3A4KCNH2CDK4TNK2
SCHEMBL14633843 0.84 WEE1 (0.53) WEE1CYP3A4KCNH2
SCHEMBL14633100 0.84 WEE1 (0.58) WEE1CYP3A4KCNH2CDK4
SCHEMBL14633489 0.84 WEE1 (0.58) WEE1CYP3A4KCNH2CDK4TNK2
SCHEMBL14633407 0.84 WEE1 (0.60) WEE1CYP3A4KCNH2CDK4TNK2
SCHEMBL14633087 0.84 WEE1 (0.54) WEE1CYP3A4KCNH2CDK4
SCHEMBL14633009 0.83 WEE1 (0.61) WEE1CYP3A4KCNH2CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8796289-B2 Pyridazino[4,5-D]pyrimidin-5(6H)-one inhibitors of kinases ABBVIE INC. (US) 2014-08-05 — — US claimed
WO-2013013031-A1 PYRIDAZINO [4, 5 -D] PYRIMIDIN- (6H) -ONE INHIBITORS OF WEE - 1 KINASE ABBVIE INC. (US) 2013-01-24 — — WO claimed
US-20130023523-A1 PYRIDAZINO[4,5-D]PYRIMIDIN-5(6H)-ONE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2013-01-24 — — US claimed
US-9051327-B2 Pyridazino[4,5-D]pyrimidin-5(6H)-one inhibitors of kinases ABBVIE INC. (US) 2015-06-09 — — US disclosed
US-20140296220-A1 PYRIDAZINO[4,5-D]PYRIMIDIN-5(6H)-ONE INHIBITORS OF KINASES ABBVIE INC (US) 2014-10-02 — — US disclosed
US-8796289-B2 Pyridazino[4,5-D]pyrimidin-5(6H)-one inhibitors of kinases ABBVIE INC. (US) 2014-08-05 — — US disclosed
WO-2013013031-A1 PYRIDAZINO [4, 5 -D] PYRIMIDIN- (6H) -ONE INHIBITORS OF WEE - 1 KINASE ABBVIE INC. (US) 2013-01-24 — — WO disclosed
US-20130023523-A1 PYRIDAZINO[4,5-D]PYRIMIDIN-5(6H)-ONE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2013-01-24 — — 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 (2 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-20140296220-A1 PYRIDAZINO[4,5-D]PYRIMIDIN-5(6H)-ONE INHIBITORS OF KINASES WEE1, WEE2, CDK1 WEE1 1/4885CYP3A4 1925/4885KCNH2 1681/4885
US-20130023523-A1 PYRIDAZINO[4,5-D]PYRIMIDIN-5(6H)-ONE INHIBITORS OF KINASES WEE1, WEE2, CDK1 WEE1 1/4885CYP3A4 1925/4885KCNH2 1681/4885

“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.

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