SCHEMBL14633767

SCHEMBL14633767

COc1ccc2[nH]nc(-c3cnc(Nc4cc(OC)c(OC)c(OC)c4)nc3N)c2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 0.49
AURKB Q96GD4 3/20 0.49
AURKA O14965 2/20 0.49
IGF1R P08069 4/20 0.46
GAK O14976 2/20 0.45
RIPK2 O43353 2/20 0.45
COQ8A Q8NI60 2/20 0.45
NLK Q9UBE8 2/20 0.45
LCK P06239 4/20 0.45
RET P07949 2/20 0.45
PTK2 Q05397 2/20 0.45
DAPK3 O43293 1/20 0.45
JAK2 O60674 1/20 0.45
PAK4 O96013 1/20 0.45
ABL1 P00519 1/20 0.45
NTRK1 P04629 1/20 0.45
FYN P06241 1/20 0.45
CSF1R P07333 1/20 0.45
MET P08581 1/20 0.45
PDGFRB P09619 1/20 0.45

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
SCHEMBL2467117 0.90 KDR (0.51) KDRAURKBAURKAIGF1RGAK
SCHEMBL2470494 0.85 KDR (0.53) KDRAURKBAURKAIGF1RLCK
SCHEMBL2532975 0.80 KDR (0.53) KDRAURKBAURKAIGF1RGAK
SCHEMBL14633757 0.78 GAK (0.46) KDRAURKBAURKAIGF1RGAK
SCHEMBL6419728 0.77 KDR (0.49) KDRAURKBAURKAIGF1RPTK2
SCHEMBL14634094 0.77 IGF1R (0.59) KDRIGF1RGAKRIPK2COQ8A
SCHEMBL2467824 0.77 CDK9 (0.42) KDRAURKBAURKARIPK2LCK
SCHEMBL2470822 0.76 ALDH1A1 (0.47) RIPK2LRRK2
SCHEMBL6312611 0.75 KDR (0.52) KDRAURKBAURKAIGF1RGAK
SCHEMBL2469734 0.74 SYK (0.44) KDRAURKBAURKAIGF1RGAK

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-20130023534-A1 PYRAZOLYL-PYRIMIDINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-24 US claimed
US-20130023532-A1 INDAZOLYL-PYRIMIDINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-24 US claimed
US-20130023532-A1 INDAZOLYL-PYRIMIDINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-24 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 (2 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-20130023532-A1 INDAZOLYL-PYRIMIDINES AS KINASE INHIBITORS MAP3K19, MAP3K1, MAP3K20 KDR 541/4885AURKB 123/4885AURKA 70/4885
US-20130023534-A1 PYRAZOLYL-PYRIMIDINES AS KINASE INHIBITORS CDK2, MAP3K19, MAP3K1 KDR 546/4885AURKB 111/4885AURKA 70/4885

“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.