SCHEMBL3764779

SCHEMBL3764779

CNC(=O)c1cc2c(cnn2C)cc1Nc1nc(Nc2ccc(N3CCC(N(C)C)CC3)cc2)ncc1Br

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 1/20 0.51
▸ PLK1 P53350 1/20 0.49
▸ EGFR P00533 5/20 0.49
▸ ULK1 O75385 1/20 0.47
▸ SYK P43405 5/20 0.46
▸ PKMYT1 Q99640 2/20 0.45
▸ IGF1R P08069 2/20 0.45
▸ MAPK8 P45983 1/20 0.45
▸ MAPK9 P45984 1/20 0.45
▸ MAPK10 P53779 1/20 0.45
▸ INSR P06213 1/20 0.45
▸ PTK2 Q05397 1/20 0.45
▸ PTK2B Q14289 1/20 0.45
▸ SLC2A1 P11166 1/20 0.45
▸ TNK2 Q07912 1/20 0.43
▸ AXL P30530 1/20 0.43

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
SCHEMBL3762576 0.89 PLK1 (0.64) FGFR1PLK1EGFRULK1SYK
SCHEMBL3762926 0.85 EGFR (0.50) PLK1EGFRSYKIGF1RTNK2
SCHEMBL3760283 0.84 EGFR (0.48) PLK1EGFRSYKIGF1RTNK2
SCHEMBL3762506 0.80 ULK1 (0.75) FGFR1PLK1EGFRULK1SYK
SCHEMBL3771362 0.77 ULK1 (0.61) FGFR1PLK1EGFRULK1SYK
SCHEMBL3766732 0.75 PLK1 (0.62) PLK1EGFRULK1IGF1RINSR
SCHEMBL3766371 0.75 PLK1 (0.62) PLK1EGFRULK1IGF1RINSR
SCHEMBL3756737 0.74 PLK1 (0.61) PLK1EGFRULK1IGF1RINSR
SCHEMBL3766662 0.73 PLK1 (0.60) FGFR1PLK1EGFRULK1SYK
SCHEMBL3764381 0.73 EGFR (0.48) FGFR1EGFRSYKIGF1RTNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2435422-B1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBVIE INC (US) 2014-12-17 — — EP claimed
US-8486933-B2 Pyrimidine inhibitors of kinase activity ABBVIE INC. (US) 2013-07-16 — — US claimed
US-20100305112-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 — — US claimed
EP-2435422-B1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBVIE INC (US) 2014-12-17 — — EP disclosed
US-8486933-B2 Pyrimidine inhibitors of kinase activity ABBVIE INC. (US) 2013-07-16 — — US disclosed
US-20100305112-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-20100305112-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY IGF1R, TK1, CDK2 FGFR1 7/4885PLK1 60/4885EGFR 120/4885

“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.

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