SCHEMBL3764899

SCHEMBL3764899

COc1cc(C2CCNCC2)ccc1Nc1nccc(-c2c(Cl)nc3ccccn23)n1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 5/20 0.63
KCNH2 Q12809 4/20 0.63
EGFR P00533 9/20 0.53
ALK Q9UM73 4/20 0.50
MET P08581 1/20 0.49
CDK2 P24941 1/20 0.48
INSR P06213 1/20 0.47

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
SCHEMBL3761151 0.84 CDK2 (0.56) IGF1REGFRCDK2INSR
SCHEMBL3762013 0.82 CDK2 (0.62) IGF1REGFRCDK2
SCHEMBL3763040 0.82 IGF1R (0.52) IGF1RKCNH2EGFRINSR
SCHEMBL3765209 0.81 CDK2 (0.52) IGF1REGFRCDK2INSR
SCHEMBL3759789 0.79 IGF1R (0.58) IGF1RKCNH2EGFRINSR
SCHEMBL3759773 0.79 IGF1R (0.63) IGF1RKCNH2EGFRALKINSR
SCHEMBL3760432 0.78 IGF1R (0.55) IGF1REGFRALKINSR
SCHEMBL310601 0.78 INSR (0.75) IGF1REGFRINSR
SCHEMBL3311294 0.77 IGF1R (1.00) IGF1RKCNH2CDK2INSR
SCHEMBL3756635 0.77 EGFR (0.53) IGF1RKCNH2EGFRCDK2INSR

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 4 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 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 IGF1R 1/4885KCNH2 1742/4885EGFR 328/4885

“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.