SCHEMBL12005347

SCHEMBL12005347

Cc1cc(Nc2ncc3c(=O)n(-c4ccccc4Cl)c4nccn4c3n2)ccc1N1CCNCC1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
WEE1 P30291 18/20 0.68
KCNH2 Q12809 1/20 0.60
CDK4 P11802 1/20 0.53
CCND1 P24385 1/20 0.53
CCND2 P30279 1/20 0.53
CCND3 P30281 1/20 0.53

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
SCHEMBL31557122 1.00 WEE1 (0.68) WEE1KCNH2CDK4CCND1CCND2
SCHEMBL31557186 0.97 WEE1 (0.67) WEE1KCNH2CDK4CCND1CCND2
SCHEMBL12005636 0.97 WEE1 (0.67) WEE1KCNH2CDK4CCND1CCND2
SCHEMBL31557126 0.93 WEE1 (0.66) WEE1KCNH2
SCHEMBL12006282 0.93 WEE1 (0.66) WEE1KCNH2
SCHEMBL12005452 0.92 WEE1 (0.80) WEE1
SCHEMBL31556946 0.92 WEE1 (0.80) WEE1
SCHEMBL12005571 0.90 WEE1 (0.62) WEE1KCNH2CDK4CCND1CCND2
SCHEMBL12005009 0.89 WEE1 (0.64) WEE1KCNH2
SCHEMBL31557120 0.89 WEE1 (0.75) WEE1

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
EP-2681221-B1 TRICYCLIC INHIBITORS OF KINASES ABBVIE INC (US) 2016-05-18 EP claimed
EP-2681221-A1 TRICYCLIC INHIBITORS OF KINASES AbbVie Inc. (US) 2014-01-08 EP claimed
WO-2012161812-A1 TRICYCLIC INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-11-29 WO claimed
US-20120220572-A1 TRICYCLIC INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-08-30 US claimed
EP-2681221-B1 TRICYCLIC INHIBITORS OF KINASES ABBVIE INC (US) 2016-05-18 EP disclosed
US-8710065-B2 Tricyclic inhibitors of kinases ABBVIE INC. (US) 2014-04-29 US disclosed
EP-2681221-A1 TRICYCLIC INHIBITORS OF KINASES AbbVie Inc. (US) 2014-01-08 EP disclosed
WO-2012161812-A1 TRICYCLIC INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-11-29 WO disclosed
US-20120220572-A1 TRICYCLIC INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-08-30 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 (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-20120220572-A1 TRICYCLIC INHIBITORS OF KINASES WEE1, WEE2, CDK1 WEE1 1/4885KCNH2 1593/4885CDK4 94/4885

“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.