SCHEMBL3764381

SCHEMBL3764381

CCS(=O)(=O)c1cc2c(cnn2C)cc1Nc1nc(Nc2ccc(N3CCS(=O)(=O)CC3)cc2)ncc1Br

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 11/20 0.48
▸ IGF1R P08069 4/20 0.46
▸ FGFR1 P11362 1/20 0.45
▸ PDGFRB P09619 1/20 0.44
▸ PDGFRA P16234 1/20 0.44
▸ SYK P43405 1/20 0.44
▸ TNK2 Q07912 1/20 0.43
▸ BRD4 O60885 2/20 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 0.87 EGFR (0.48) EGFRIGF1RSYKTNK2BRD4
SCHEMBL3762926 0.80 EGFR (0.50) EGFRIGF1RSYKTNK2BRD4
SCHEMBL3766726 0.80 ULK1 (0.65) EGFRIGF1RFGFR1PDGFRBSYK
SCHEMBL3756752 0.77 ALK (0.56) EGFRIGF1RFGFR1
SCHEMBL3763429 0.77 ALK (0.60) EGFRIGF1RFGFR1PDGFRBPDGFRA
SCHEMBL3756737 0.77 PLK1 (0.61) EGFRIGF1R
SCHEMBL3764779 0.73 FGFR1 (0.51) EGFRIGF1RFGFR1SYKTNK2
SCHEMBL3756677 0.73 EGFR (0.54) EGFRIGF1RFGFR1PDGFRBPDGFRA
SCHEMBL3769118 0.73 ULK1 (0.66) EGFRIGF1R
SCHEMBL3758981 0.70 ALK (0.56) EGFRIGF1RFGFR1PDGFRBPDGFRA

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 120/4885IGF1R 1/4885FGFR1 7/4885

“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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