SCHEMBL3768992

SCHEMBL3768992

COc1ccccc1COc1ccc(-c2nc3ccccn3c2-c2ccnc(Nc3cccc(CCN(C)C)c3)n2)cc1

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CDK19 Q9BWU1 3/20 0.79
ALK Q9UM73 2/20 0.79
INSR P06213 1/20 0.56
IGF1R P08069 11/20 0.51
EGFR P00533 3/20 0.49
ERBB2 P04626 3/20 0.49
PTK2 Q05397 1/20 0.49
CDK1 P06493 1/20 0.44
CDK4 P11802 1/20 0.44
CCNE1 P24864 1/20 0.44
CDK2 P24941 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
SCHEMBL3719823 0.91 CDK19 (0.80) CDK19ALKINSRIGF1REGFR
SCHEMBL3766684 0.91 CDK19 (0.82) CDK19ALKINSRIGF1REGFR
SCHEMBL3716630 0.91 CDK19 (0.87) CDK19ALKINSRIGF1REGFR
SCHEMBL3724787 0.89 CDK19 (0.81) CDK19ALKINSRIGF1REGFR
SCHEMBL3716738 0.87 CDK19 (0.81) CDK19ALKINSRIGF1REGFR
SCHEMBL3721829 0.87 CDK19 (0.86) CDK19ALKINSRIGF1REGFR
SCHEMBL3767668 0.86 CDK19 (0.81) CDK19ALKINSRIGF1REGFR
SCHEMBL3762589 0.86 CDK19 (0.72) CDK19ALKINSRIGF1REGFR
SCHEMBL3760517 0.84 CDK19 (0.64) CDK19ALKINSRIGF1REGFR
SCHEMBL3771405 0.84 CDK19 (0.80) CDK19ALKINSRIGF1REGFR

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
EP-2435436-B1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBVIE INC (US) 2014-07-30 EP claimed
US-8354422-B2 Pyrimidine inhibitors of kinase activity ABBOTT LABORATORIES INC. (US) 2013-01-15 US claimed
WO-2010138576-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 WO claimed
US-20100305126-A1 Pyrimidine Inhibitors of Kinase Activity ABBOTT LABORATORIES (US) 2010-12-02 US claimed
EP-2435436-B1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBVIE INC (US) 2014-07-30 EP disclosed
US-8354422-B2 Pyrimidine inhibitors of kinase activity ABBOTT LABORATORIES INC. (US) 2013-01-15 US disclosed
WO-2010138576-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 WO disclosed
US-20100305126-A1 Pyrimidine Inhibitors of Kinase Activity ABBOTT LABORATORIES (US) 2010-12-02 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-20100305126-A1 Pyrimidine Inhibitors of Kinase Activity IGF1R, CDK2, TK1 CDK19 53/4885ALK 534/4885INSR 37/4885

“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.