SCHEMBL5568327

SCHEMBL5568327

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(O)c(C(F)(F)F)c3)cc2)ccn1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 14/20 0.80
KDR P35968 6/20 0.80
RET P07949 4/20 0.80
BRAF P15056 4/20 0.80
EPHX2 P34913 3/20 0.80
ABL1 P00519 3/20 0.80
SRC P12931 3/20 0.80
EPHA2 P29317 3/20 0.80
MAPK14 Q16539 3/20 0.80
MAP3K20 Q9NYL2 3/20 0.80
AURKB Q96GD4 3/20 0.80
PLK4 O00444 2/20 0.80
AURKA O14965 2/20 0.80
MAPK13 O15264 2/20 0.80
MAP4K4 O95819 2/20 0.80
LCK P06239 2/20 0.80
FYN P06241 2/20 0.80
LYN P07948 2/20 0.80
RPS6KB1 P23443 2/20 0.80
AXL P30530 2/20 0.80

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
SCHEMBL12260935 0.92 RAF1 (0.69) RAF1KDRRETBRAFEPHX2
SCHEMBL24402299 0.91 RAF1 (0.69) RAF1KDRRETBRAFEPHX2
SCHEMBL19878475 0.90 RAF1 (0.80) RAF1KDRRETBRAFEPHX2
SCHEMBL13885368 0.90 RAF1 (0.80) RAF1KDRRETBRAFEPHX2
Sorafenib SCHEMBL29349634 0.89 RAF1 (1.00) RAF1KDRRETBRAFEPHX2
Sorafenib SCHEMBL8218 0.89 RAF1 (1.00) RAF1KDRRETBRAFEPHX2
SCHEMBL549001 0.89 RAF1 (1.00) RAF1KDRRETBRAFEPHX2
SCHEMBL1532269 0.89 RAF1 (0.79) RAF1KDRRETBRAFEPHX2
Sorafenib SCHEMBL14739751 0.89 RAF1 (1.00) RAF1KDRRETBRAFEPHX2
SCHEMBL10203624 0.89 RAF1 (0.79) RAF1KDRRETBRAFEPHX2

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
US-20070161677-A1 Bisarylurea derivatives MERCK PATENT GMBH (DE) 2007-07-12 US 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 RAF1 2/4885KDR 532/4885RET 40/4885

“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.