SCHEMBL14633459

SCHEMBL14633459

O=C1CCCN1c1ccc(-c2nn(-c3c(Cl)cccc3Cl)c(=O)c3cnc(Nc4ccc(C5CCNCC5)cc4)nc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ WEE1 P30291 13/20 0.48
▸ KCNH2 Q12809 1/20 0.44
▸ MAPK8 P45983 1/20 0.41
▸ MAPK9 P45984 1/20 0.41
▸ MAPK10 P53779 1/20 0.41
▸ CSF1R P07333 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ BTK Q06187 1/20 0.40
▸ STK17A Q9UEE5 1/20 0.39
▸ TNK2 Q07912 1/20 0.39

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
SCHEMBL14633087 0.90 WEE1 (0.54) WEE1KCNH2MAPK8MAPK9MAPK10
SCHEMBL14633396 0.84 WEE1 (0.59) WEE1KCNH2CYP3A4
SCHEMBL14633640 0.84 WEE1 (0.53) WEE1BTK
SCHEMBL14632898 0.81 WEE1 (0.55) WEE1KCNH2CYP3A4BTKSTK17A
SCHEMBL14633112 0.80 MAPK8 (0.49) WEE1KCNH2MAPK8MAPK9MAPK10
SCHEMBL14633683 0.76 WEE1 (0.56) WEE1KCNH2CYP3A4BTK
SCHEMBL14632988 0.76 WEE1 (0.50) WEE1KCNH2CYP3A4BTKTNK2
SCHEMBL14633350 0.75 WEE1 (0.59) WEE1CYP3A4
SCHEMBL14633553 0.75 WEE1 (0.61) WEE1KCNH2CYP3A4
SCHEMBL14633436 0.74 WEE1 (0.61) WEE1KCNH2CYP3A4

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 1/4885KCNH2 1681/4885MAPK8 151/4885
US-20130023523-A1 PYRIDAZINO[4,5-D]PYRIMIDIN-5(6H)-ONE INHIBITORS OF KINASES WEE1, WEE2, CDK1 WEE1 1/4885KCNH2 1681/4885MAPK8 151/4885

“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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