SCHEMBL3756677

SCHEMBL3756677

CCS(=O)(=O)c1cc2[nH]ncc2cc1Nc1nc(Nc2ccc(N3CCC(N(C)C)CC3)cc2)ncc1Br

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 4/20 0.54
▸ FGFR1 P11362 3/20 0.54
▸ AXL P30530 1/20 0.48
▸ PLK1 P53350 1/20 0.46
▸ PDGFRA P16234 6/20 0.46
▸ JAK2 O60674 5/20 0.46
▸ WEE1 P30291 4/20 0.46
▸ ALK Q9UM73 4/20 0.46
▸ PDGFRB P09619 4/20 0.46
▸ IGF1R P08069 4/20 0.46
▸ JAK3 P52333 3/20 0.46
▸ AURKA O14965 2/20 0.46
▸ DAPK3 O43293 2/20 0.46
▸ PRKD3 O94806 2/20 0.46
▸ MAP4K4 O95819 2/20 0.46
▸ PAK4 O96013 2/20 0.46
▸ LCK P06239 2/20 0.46
▸ FYN P06241 2/20 0.46
▸ CSF1R P07333 2/20 0.46
▸ RET P07949 2/20 0.46

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
SCHEMBL3766664 0.89 PLK1 (0.60) EGFRPLK1PDGFRAALKPDGFRB
SCHEMBL3760283 0.86 EGFR (0.48) EGFRAXLPLK1JAK2IGF1R
SCHEMBL3761718 0.80 PLK1 (0.60) EGFRPLK1ALKIGF1RAURKA
SCHEMBL3761418 0.80 ULK1 (0.64) EGFRFGFR1PLK1PDGFRAJAK2
SCHEMBL3762926 0.79 EGFR (0.50) EGFRAXLPLK1JAK2ALK
SCHEMBL3760015 0.77 PLK1 (0.65) EGFRPLK1PDGFRAALKPDGFRB
SCHEMBL3756737 0.76 PLK1 (0.61) EGFRPLK1ALKIGF1RAURKA
SCHEMBL3771264 0.76 PLK1 (0.63) EGFRPLK1PDGFRAALKPDGFRB
SCHEMBL3766658 0.75 PLK1 (0.62) EGFRFGFR1PLK1PDGFRAALK
SCHEMBL3761696 0.73 PLK1 (0.59) EGFRPLK1PDGFRAALKPDGFRB

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 120/4885FGFR1 7/4885AXL 136/4885

“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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