SCHEMBL4485385

SCHEMBL4485385

CCOC(=O)c1cc(-c2ccc(Oc3ccnc(C(=O)NC)c3)cc2)c[nH]1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.52
RAF1 P04049 5/20 0.48
EPHX2 P34913 1/20 0.48
BRAF P15056 6/20 0.48
CCNC P24863 1/20 0.47
CDK8 P49336 1/20 0.47
HIPK4 Q8NE63 2/20 0.47
MET P08581 1/20 0.45
FLT3 P36888 1/20 0.45
MAPK14 Q16539 1/20 0.43
P2RX3 P56373 1/20 0.43
CSF1R P07333 1/20 0.43

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
SCHEMBL4474322 0.86 KDR (0.55) KDRRAF1EPHX2BRAFCCNC
SCHEMBL5725068 0.85 KDR (0.49) KDRRAF1EPHX2BRAFHIPK4
SCHEMBL5427870 0.82 KDR (0.59) KDRRAF1EPHX2BRAFCCNC
SCHEMBL4467015 0.80 KDR (0.59) KDRRAF1EPHX2BRAFCCNC
SCHEMBL9283605 0.79 KDR (0.54) KDRRAF1EPHX2BRAFHIPK4
SCHEMBL19478142 0.79 RAF1 (0.52) KDRRAF1EPHX2BRAF
SCHEMBL4463501 0.79 KDR (0.52) KDRRAF1EPHX2BRAFCCNC
SCHEMBL4474468 0.77 KDR (0.46) KDRRAF1EPHX2BRAFCCNC
SCHEMBL19478118 0.77 BRAF (0.56) KDRRAF1EPHX2BRAFMAPK14
SCHEMBL16676693 0.77 KDR (0.70) KDRRAF1EPHX2BRAFHIPK4

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 7 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 disclosed
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-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-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
US-20070149594-A1 Pyrrole derivatives MERCK PATENT GMBH (DE) 2007-06-28 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 KDR 2076/4885RAF1 1/4885EPHX2 2963/4885

“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.