SCHEMBL1171995

SCHEMBL1171995

COc1cc(Nc2nccc(Nc3cccc4[nH]ccc34)n2)cc(OC)c1OC

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHB4 P54760 2/20 0.59
IGF1R P08069 12/20 0.59
JAK2 O60674 1/20 0.58
JAK3 P52333 1/20 0.58
KDR P35968 2/20 0.54
EGFR P00533 2/20 0.54
INSR P06213 1/20 0.54
MET P08581 1/20 0.54
CDK2 P24941 1/20 0.54
TEK Q02763 1/20 0.54
BRD4 O60885 1/20 0.53
BRAF P15056 1/20 0.53
AURKA O14965 1/20 0.52
RET P07949 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
SCHEMBL1172054 0.85 IGF1R (0.67) EPHB4IGF1RKDREGFRINSR
SCHEMBL1172210 0.85 IGF1R (0.61) IGF1RKDREGFRINSRMET
SCHEMBL1172768 0.81 IGF1R (0.64) IGF1RKDREGFRINSRMET
SCHEMBL1172280 0.81 IGF1R (0.67) IGF1RKDREGFRINSRMET
SCHEMBL1116462 0.80 IGF1R (0.79) EPHB4IGF1RJAK2KDREGFR
SCHEMBL1172205 0.79 JAK2 (0.59) IGF1RJAK2KDREGFRINSR
SCHEMBL13866467 0.78 PTK2 (0.65) IGF1RJAK2JAK3KDREGFR
SCHEMBL12865250 0.78 IGF1R (0.66) EPHB4IGF1RKDREGFRINSR
SCHEMBL1171685 0.78 EPHB4 (0.71) EPHB4IGF1RJAK2KDREGFR
SCHEMBL6981464 0.77 IGF1R (0.78) IGF1RKDREGFRINSRMET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110046108-A1 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2011-02-24 US disclosed
EP-1981856-A2 PYRIMIDINE DERIVATIVES AstraZeneca AB (SE) 2008-10-22 EP disclosed
WO-2007085833-A2 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2007-08-02 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-20110046108-A1 PYRIMIDINE DERIVATIVES EPHB4, EPHB1, EPHB3 EPHB4 1/4885IGF1R 1124/4885JAK2 23/4885

“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.