SCHEMBL6319752

SCHEMBL6319752

COc1cc(Nc2nccc(Nc3cnc4ccccc4c3)n2)ccc1C(N)=O

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 15/20 0.78
EGFR P00533 1/20 0.69
INSR P06213 1/20 0.69
MET P08581 1/20 0.69
CDK2 P24941 1/20 0.69
KDR P35968 1/20 0.69
TEK Q02763 1/20 0.69
AURKA O14965 2/20 0.56
AURKB Q96GD4 2/20 0.56
MAPK8 P45983 2/20 0.51
MAPK9 P45984 1/20 0.51
CDC7 O00311 1/20 0.51

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
SCHEMBL31378824 0.85 IGF1R (0.82) IGF1REGFRINSRMETCDK2
SCHEMBL6320786 0.84 IGF1R (0.66) IGF1REGFRINSRMETCDK2
SCHEMBL6313016 0.82 IGF1R (0.68) IGF1REGFRINSRMETCDK2
SCHEMBL6313665 0.81 IGF1R (0.82) IGF1REGFRINSRMETCDK2
SCHEMBL6313147 0.78 IGF1R (0.64) IGF1REGFRINSRMETCDK2
SCHEMBL6319619 0.78 IGF1R (0.64) IGF1REGFRINSRMETCDK2
SCHEMBL6313144 0.78 IGF1R (0.68) IGF1REGFRINSRMETCDK2
SCHEMBL31592567 0.77 IGF1R (0.82) IGF1REGFRINSRMETCDK2
SCHEMBL6311579 0.77 AURKA (0.73) IGF1REGFRINSRMETCDK2
SCHEMBL31592351 0.76 IGF1R (0.76) IGF1REGFRINSRMETCDK2

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-6939874-B2 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. (US) 2005-09-06 US claimed
EP-1427421-A1 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS Amgen Inc. (US) 2004-06-16 EP claimed
US-20040063705-A1 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. 2004-04-01 US claimed
WO-2003018021-A1 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS AMGEN INC. (US) 2003-03-06 WO claimed
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 4054/4885EGFR 1302/4885INSR 2763/4885

“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.