SCHEMBL14633250

SCHEMBL14633250

Cc1nn(-c2c(Cl)cccc2Cl)c(=O)c2cnc(Nc3ccc(C4CCN(C)CC4)cc3)nc12

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 2/20 0.65
▸ WEE1 P30291 14/20 0.57
▸ CYP3A4 P08684 1/20 0.54
▸ BRD4 O60885 3/20 0.49
▸ PLK1 P53350 2/20 0.48
▸ MAP4K1 Q92918 1/20 0.46
▸ JAK2 O60674 1/20 0.45
▸ BTK Q06187 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
SCHEMBL14632898 0.90 WEE1 (0.55) KCNH2WEE1CYP3A4BRD4JAK2
SCHEMBL14633423 0.87 WEE1 (0.56) KCNH2WEE1CYP3A4
SCHEMBL14633306 0.86 WEE1 (0.57) KCNH2WEE1CYP3A4BRD4JAK2
SCHEMBL14632964 0.86 WEE1 (0.72) KCNH2WEE1CYP3A4
SCHEMBL14633403 0.86 WEE1 (0.54) KCNH2WEE1CYP3A4
SCHEMBL14632959 0.86 KCNH2 (0.48) KCNH2WEE1CYP3A4BTK
SCHEMBL14633753 0.85 WEE1 (0.49) KCNH2WEE1CYP3A4BRD4
SCHEMBL14633364 0.84 WEE1 (0.56) KCNH2WEE1CYP3A4
SCHEMBL15206353 0.84 WEE1 (0.75) KCNH2WEE1CYP3A4BRD4PLK1
SCHEMBL14632907 0.84 WEE1 (0.58) KCNH2WEE1CYP3A4BTK

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 9 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-20140288062-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. 2014-09-25 — — 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 (3 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 KCNH2 1681/4885WEE1 1/4885CYP3A4 1925/4885
US-20140288062-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF COMT, GPR119, NLN KCNH2 2782/4885WEE1 3398/4885CYP3A4 191/4885
US-20130023523-A1 PYRIDAZINO[4,5-D]PYRIMIDIN-5(6H)-ONE INHIBITORS OF KINASES WEE1, WEE2, CDK1 KCNH2 1681/4885WEE1 1/4885CYP3A4 1925/4885

“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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