SCHEMBL3762926

SCHEMBL3762926

CN(C)C1CCN(c2ccc(Nc3ncc(Br)c(Nc4cc5cnn(C)c5cc4S(C)(=O)=O)n3)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 7/20 0.50
▸ PLK1 P53350 1/20 0.47
▸ SYK P43405 1/20 0.46
▸ ALK Q9UM73 1/20 0.46
▸ JAK2 O60674 6/20 0.46
▸ BRD4 O60885 6/20 0.46
▸ IGF1R P08069 1/20 0.44
▸ JAK1 P23458 1/20 0.44
▸ BRD2 P25440 1/20 0.44
▸ JAK3 P52333 1/20 0.44
▸ BRD3 Q15059 1/20 0.44
▸ BRDT Q58F21 1/20 0.44
▸ TNK2 Q07912 1/20 0.44
▸ AXL P30530 1/20 0.44
▸ FGFR4 P22455 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
SCHEMBL3760283 0.93 EGFR (0.48) EGFRPLK1SYKJAK2BRD4
SCHEMBL3766371 0.89 PLK1 (0.62) EGFRPLK1ALKIGF1R
SCHEMBL3764779 0.85 FGFR1 (0.51) EGFRPLK1SYKIGF1RTNK2
SCHEMBL3756737 0.83 PLK1 (0.61) EGFRPLK1ALKIGF1R
SCHEMBL3766662 0.82 PLK1 (0.60) EGFRPLK1SYKALKJAK2
SCHEMBL3764381 0.80 EGFR (0.48) EGFRSYKBRD4IGF1RTNK2
SCHEMBL3756677 0.79 EGFR (0.54) EGFRPLK1SYKALKJAK2
SCHEMBL3769118 0.79 ULK1 (0.66) EGFRALKIGF1R
SCHEMBL15797719 0.77 EGFR (0.53) EGFRPLK1SYKJAK2BRD4
SCHEMBL3758981 0.77 ALK (0.56) EGFRPLK1SYKALKJAK2

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
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
WO-2010138578-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 — — WO 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
WO-2010138578-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 — — WO 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 EGFR 120/4885PLK1 60/4885SYK 980/4885

“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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