SCHEMBL4466716

SCHEMBL4466716

CNC(=O)c1cc(Oc2cccc(-c3c[nH]c(C(=O)Nc4ccc(Br)c(C(F)(F)F)c4)c3)c2)ccn1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 12/20 0.65
RET P07949 4/20 0.57
BRAF P15056 7/20 0.52
KDR P35968 7/20 0.52
ABL1 P00519 3/20 0.52
EPHA2 P29317 3/20 0.52
MAPK14 Q16539 3/20 0.52
MAP3K20 Q9NYL2 3/20 0.52
SRC P12931 3/20 0.52
AURKB Q96GD4 3/20 0.52
EPHX2 P34913 3/20 0.52
PLK4 O00444 2/20 0.52
AURKA O14965 2/20 0.52
MAPK13 O15264 2/20 0.52
MAP4K4 O95819 2/20 0.52
LCK P06239 2/20 0.52
FYN P06241 2/20 0.52
LYN P07948 2/20 0.52
RPS6KB1 P23443 2/20 0.52
AXL P30530 2/20 0.52

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
SCHEMBL4466558 0.91 RET (0.71) RAF1RETBRAFKDRABL1
SCHEMBL9105151 0.88 RAF1 (0.50) RAF1RETBRAFKDRABL1
SCHEMBL9106204 0.87 KDR (0.65) RAF1RETBRAFKDRABL1
SCHEMBL1380435 0.86 RAF1 (0.46) RAF1RETKDRFLT1MEN1
SCHEMBL4469341 0.85 BRAF (0.56) RAF1RETBRAFKDRABL1
SCHEMBL4473424 0.84 KDR (0.54) RAF1RETBRAFKDRABL1
SCHEMBL4466760 0.84 KDR (0.70) RAF1RETBRAFKDRABL1
SCHEMBL4463621 0.83 RET (0.55) RAF1RETBRAFKDRABL1
SCHEMBL1506420 0.83 RAF1 (0.86) RAF1RETBRAFKDRABL1
SCHEMBL4474992 0.82 RAF1 (0.72) RAF1RETBRAFKDRABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685125-B1 Pyrrole derivatives useful for the treatment of proliferative diseases MERCK PATENT GMBH (DE) 2012-06-06 EP claimed
US-7598274-B2 N-methyl-4-{4-[5-(4-chloro-3-trifluoromethylphenylcarbamoyl)-1H-pyrrol-3-yl]-phenoxy}pyridine-2-carboxamide; Raf kinases inhibitors MERCK PATENT GMBH (DE) 2009-10-06 US claimed
US-20070149594-A1 Pyrrole derivatives MERCK PATENT GMBH (DE) 2007-06-28 US claimed
US-7598274-B2 N-methyl-4-{4-[5-(4-chloro-3-trifluoromethylphenylcarbamoyl)-1H-pyrrol-3-yl]-phenoxy}pyridine-2-carboxamide; Raf kinases inhibitors MERCK PATENT GMBH (DE) 2009-10-06 US disclosed
US-20070149594-A1 Pyrrole derivatives MERCK PATENT GMBH (DE) 2007-06-28 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-20070149594-A1 Pyrrole derivatives RAF1, BRAF, ARAF RAF1 1/4885RET 36/4885BRAF 2/4885

“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.