SCHEMBL5564737

SCHEMBL5564737

CNCCOc1cc(Cl)c(C)cc1NC(=O)Nc1cccc(Oc2ccnc(C(=O)NC)c2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 4/20 0.58
GSK3B P49841 2/20 0.56
KDR P35968 5/20 0.50
MAPK14 Q16539 4/20 0.50
ABL1 P00519 3/20 0.50
EPHA2 P29317 3/20 0.50
MAP3K20 Q9NYL2 3/20 0.50
AURKB Q96GD4 3/20 0.50
PLK4 O00444 2/20 0.50
AURKA O14965 2/20 0.50
MAPK13 O15264 2/20 0.50
MAP4K4 O95819 2/20 0.50
LCK P06239 2/20 0.50
FYN P06241 2/20 0.50
LYN P07948 2/20 0.50
SRC P12931 2/20 0.50
RPS6KB1 P23443 2/20 0.50
AXL P30530 2/20 0.50
FRK P42685 2/20 0.50
MAPK9 P45984 2/20 0.50

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
SCHEMBL13648368 0.93 RET (0.50) RETGSK3BKDRMAPK14ABL1
SCHEMBL5570191 0.92 RET (0.58) RETGSK3BKDRMAPK14ABL1
SCHEMBL5564720 0.92 GSK3B (0.65) RETGSK3BKDRMAPK14ABL1
SCHEMBL5568977 0.90 RET (0.57) RETGSK3BKDRMAPK14ABL1
SCHEMBL14453625 0.89 GSK3B (0.71) RETGSK3BKDRMAPK14ABL1
SCHEMBL171041 0.88 DDR2 (0.58) RETGSK3BKDRMAPK14ABL1
SCHEMBL5565578 0.88 RET (0.54) RETGSK3BKDRMAPK14ABL1
SCHEMBL13648441 0.86 GSK3B (0.48) RETGSK3BKDRMAPK14ABL1
SCHEMBL13648371 0.85 RET (0.50) RETGSK3BKDRMAPK14ABL1
SCHEMBL171326 0.85 DDR2 (0.59) RETGSK3BKDRMAPK14ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007519653-A 2007-07-19 JP claimed
US-20070161677-A1 Bisarylurea derivatives MERCK PATENT GMBH (DE) 2007-07-12 US claimed
EP-1730111-A2 SUBSTITUTED BISARYLUREA DERIVATIVES AS KINASE INHIBITORS MERCK PATENT GmbH (DE) 2006-12-13 EP claimed
WO-2005075425-A2 SUBSTITUTED BISARYLUREA DERIVATIVES AS KINASE INHIBITORS MERCK PATENT GMBH (DE) 2005-08-18 WO claimed
US-20070161677-A1 Bisarylurea derivatives MERCK PATENT GMBH (DE) 2007-07-12 US disclosed
US-20070161677-A1 Bisarylurea derivatives MERCK PATENT GMBH (DE) 2007-07-12 US disclosed
US-20070161677-A1 Bisarylurea derivatives MERCK PATENT GMBH (DE) 2007-07-12 US disclosed
EP-1730111-A2 SUBSTITUTED BISARYLUREA DERIVATIVES AS KINASE INHIBITORS MERCK PATENT GmbH (DE) 2006-12-13 EP disclosed
WO-2005075425-A2 SUBSTITUTED BISARYLUREA DERIVATIVES AS KINASE INHIBITORS MERCK PATENT GMBH (DE) 2005-08-18 WO 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-20070161677-A1 Bisarylurea derivatives BRAF, RAF1, NRAS RET 40/4885GSK3B 352/4885KDR 532/4885

“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.