SCHEMBL13815845

SCHEMBL13815845

CC(C)(C)c1cc(NC(=O)CNc2ccc(Oc3ccccc3)cc2)no1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 18/20 0.72
MAPK13 O15264 1/20 0.72
MAPK12 P53778 1/20 0.72
MAPK11 Q15759 1/20 0.72
MAPK14 Q16539 1/20 0.72
RIPK2 O43353 1/20 0.58
MEN1 O00255 1/20 0.55
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
KMT2A Q03164 1/20 0.55
FLT3 P36888 1/20 0.54

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
SCHEMBL4444438 0.90 RAF1 (0.72) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL4443071 0.84 RAF1 (0.61) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL5573447 0.84 RAF1 (1.00) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL13200526 0.79 RAF1 (0.67) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL5576394 0.76 RAF1 (0.83) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL667581 0.75 RAF1 (0.85) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL667238 0.75 RAF1 (1.00) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL769541 0.74 RAF1 (0.64) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL668361 0.74 RAF1 (0.82) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL668216 0.74 RAF1 (0.77) RAF1MAPK13MAPK12MAPK11MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163556-A1 GLYCINAMIDE DERIVATIVES AS RAF-KINASE INHBITORS BUCHSTALLER HANS-PETER 2009-06-25 US disclosed
US-7476683-B2 e.g. N-(4-Chloro-3-trifluoro methyl phenyl)-2-[3-(4-pyridinyloxy)phenyl amino]-acetamide; serine/threonine kinase inhibitor; anticarcinogenic, antiproliferative, antidiabetic agent; autoimmune diseases; atherosclerosis, arthritis, Crohn's disease, retinopaty MERCK PATENT GMBH (DE) 2009-01-13 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-20090163556-A1 GLYCINAMIDE DERIVATIVES AS RAF-KINASE INHBITORS ARAF, BRAF, RAF1 RAF1 3/4885MAPK13 264/4885MAPK12 146/4885

“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.