SCHEMBL2205447

SCHEMBL2205447

COc1cc(Nc2ncc(-c3cnc4ccccc4c3)c(N)n2)cc(OC)c1OC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 10/20 0.63
KDR P35968 3/20 0.59
CDK2 P24941 2/20 0.59
EGFR P00533 1/20 0.59
INSR P06213 1/20 0.59
MET P08581 1/20 0.59
TEK Q02763 1/20 0.59
AURKA O14965 1/20 0.54
AURKB Q96GD4 1/20 0.54
PRKD3 O94806 1/20 0.47
PRKCG P05129 1/20 0.47
PRKCB P05771 1/20 0.47
LCK P06239 1/20 0.47
PRKCA P17252 1/20 0.47
PRKCH P24723 1/20 0.47
PRKCI P41743 1/20 0.47
ZAP70 P43403 1/20 0.47
PRKCE Q02156 1/20 0.47
PRKCQ Q04759 1/20 0.47
PRKCZ Q05513 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
SCHEMBL6312056 0.90 IGF1R (0.60) IGF1RKDRCDK2EGFRINSR
SCHEMBL6312611 0.88 KDR (0.52) IGF1RKDRCDK2EGFRINSR
SCHEMBL6312589 0.88 IGF1R (0.59) IGF1RKDRCDK2EGFRINSR
SCHEMBL6312590 0.87 IGF1R (0.58) IGF1RKDRCDK2EGFRINSR
SCHEMBL6320602 0.87 KDR (0.51) IGF1RKDRCDK2EGFRINSR
SCHEMBL6318900 0.86 IGF1R (0.58) IGF1RKDREGFRAURKAPOLB
SCHEMBL6319833 0.85 LRRK2 (0.46) IGF1RKDRCDK2EGFRINSR
SCHEMBL6319664 0.84 IGF1R (0.53) IGF1RKDRCDK2EGFRINSR
SCHEMBL6314422 0.83 IGF1R (0.60) IGF1RKDRCDK2EGFRAURKA
SCHEMBL6312806 0.83 IGF1R (0.47) IGF1RKDRCDK2EGFRINSR

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6939874-B2 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. (US) 2005-09-06 US claimed
US-20040063705-A1 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. 2004-04-01 US claimed
US-7981633-B2 measuring the autophosphorylation of one or more tyrosine kinases in presence of a kinase inhibitor compared to the absence of said kinase inhibitor; immuno assay for the detection of autophosphorylation of up to 100 different tyrosine kinases in one cavity MERCK PATENT GMBH (DE) 2011-07-19 US disclosed
US-20080206800-A1 Method for Measuring Tyrosine Kinase Phosphorylation MERCK PATENT GESELLSCHAFT (DE) 2008-08-28 US disclosed
US-20060193772-A1 Drugs for treating cancer JAPAN AS REPRESENTED BY PRESIDENT OF NATIONAL CANCER CENTER (JP) 2006-08-31 US disclosed
EP-1671647-A1 MEDICAMENT FOR TREATING CANCER KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-06-21 EP disclosed
US-6939874-B2 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. (US) 2005-09-06 US disclosed
EP-1427421-A1 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS Amgen Inc. (US) 2004-06-16 EP disclosed
US-20040063705-A1 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. 2004-04-01 US disclosed
WO-2003018021-A1 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS AMGEN INC. (US) 2003-03-06 WO 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-20040063705-A1 Substituted pyrimidinyl derivatives and methods of use DPYD, TYMP, TPMT IGF1R 4054/4885KDR 2148/4885CDK2 267/4885

“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.