SCHEMBL4485728

SCHEMBL4485728

CNC(=O)c1cc(Oc2cccc(-c3c[nH]c(C(=O)Nc4ccc(C)c(Cl)c4C)c3)c2)ccn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 3/20 0.43
KDR P35968 6/20 0.42
GRM5 P41594 2/20 0.41
CCNC P24863 1/20 0.40
CDK8 P49336 1/20 0.40
BRAF P15056 5/20 0.40
RAF1 P04049 4/20 0.40
ABL1 P00519 2/20 0.39
EPHA2 P29317 2/20 0.39
MAPK14 Q16539 2/20 0.39
MAP3K20 Q9NYL2 2/20 0.39
RIPK2 O43353 1/20 0.39
ABCB11 O95342 1/20 0.39
NR3C1 P04150 1/20 0.39
HTR1A P08908 1/20 0.39
PDGFRB P09619 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
KIT P10721 1/20 0.39
CHRM1 P11229 1/20 0.39
BCR P11274 1/20 0.39

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
SCHEMBL4467857 0.86 RET (0.51) RETKDRGRM5CCNCCDK8
SCHEMBL4463605 0.85 LMNA (0.46) RETKDRBRAFRAF1DDR2
SCHEMBL4473374 0.83 DDR2 (0.54) RETKDRGRM5BRAFRAF1
SCHEMBL4476005 0.83 RAF1 (0.45) RETKDRBRAFRAF1DDR2
SCHEMBL4463621 0.82 RET (0.55) RETKDRGRM5CCNCCDK8
SCHEMBL4473424 0.81 KDR (0.54) RETKDRBRAFRAF1ABL1
SCHEMBL4480264 0.81 KDR (0.43) RETKDRGRM5CCNCCDK8
SCHEMBL4485725 0.79 RET (0.50) RETKDRGRM5CCNCCDK8
SCHEMBL4485733 0.79 RET (0.42) RETKDRGRM5CCNCCDK8
SCHEMBL4470743 0.79 KDR (0.45) RETKDRCCNCCDK8BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 RET 36/4885KDR 2076/4885GRM5 3556/4885

“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.