SCHEMBL5865071

SCHEMBL5865071

CC(C)(C)c1ccc(NC(=O)Nc2ccc(-c3ccc(CN4CCOCC4)nc3)c3ccccc23)c(CCCO)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.73
ABL1 P00519 3/20 0.64
RAF1 P04049 3/20 0.64
LYN P07948 3/20 0.64
MAPK9 P45984 3/20 0.64
EGFR P00533 2/20 0.64
BRAF P15056 2/20 0.64
EPHA2 P29317 2/20 0.64
EPHA3 P29320 2/20 0.64
AKT1 P31749 1/20 0.64
SRC P12931 2/20 0.61
TNF P01375 5/20 0.40
MAPK13 O15264 3/20 0.40
MAPK12 P53778 3/20 0.40
MAPK11 Q15759 3/20 0.40
GSK3A P49840 1/20 0.40
HIF1A Q16665 1/20 0.40
EPAS1 Q99814 1/20 0.40
CIT O14578 1/20 0.39
MUSK O15146 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
SCHEMBL4092311 0.95 MAPK14 (0.75) MAPK14ABL1RAF1LYNMAPK9
SCHEMBL4098327 0.88 MAPK14 (0.81) MAPK14ABL1RAF1LYNMAPK9
SCHEMBL4085454 0.87 MAPK14 (0.82) MAPK14ABL1RAF1LYNMAPK9
SCHEMBL4091873 0.87 MAPK14 (0.81) MAPK14ABL1RAF1LYNMAPK9
SCHEMBL4091678 0.87 MAPK14 (0.81) MAPK14ABL1RAF1LYNMAPK9
SCHEMBL5864676 0.86 MAPK14 (0.78) MAPK14ABL1RAF1LYNMAPK9
SCHEMBL4092806 0.86 MAPK14 (0.80) MAPK14ABL1RAF1LYNMAPK9
SCHEMBL4096768 0.86 MAPK14 (0.77) MAPK14ABL1RAF1LYNMAPK9
SCHEMBL4092870 0.85 MAPK14 (0.79) MAPK14ABL1RAF1LYNMAPK9
SCHEMBL4087842 0.85 MAPK14 (0.79) MAPK14ABL1RAF1LYNMAPK9

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-7019006-B2 Modulating release of inflammatory cytokines by administering, e.g., a 1-(5-tert-butyl-2-methyl-phenyl)-3-(6-((3-methoxy-propyl)-methylaminopyridin-3-yl)phthalen-1-yl) urea or thiourea; treating a neutrophil-mediated disease BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2006-03-28 US disclosed
US-20040019038-A1 Compounds useful as anti-inflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-01-29 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-20040019038-A1 Compounds useful as anti-inflammatory agents NFKBIA, TNF, MPO MAPK14 2740/4885ABL1 3659/4885RAF1 2736/4885

“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.