SCHEMBL6767905

SCHEMBL6767905

CN(c1cccc(N)c1)c1nccc(-c2c(-c3ccc(F)cc3)c(=O)n(C)n2N2CCOCC2)n1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 20/20 0.40
MAPK12 P53778 20/20 0.40
MAPK11 Q15759 20/20 0.40
MAPK14 Q16539 20/20 0.40

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
SCHEMBL6764031 0.93 MAPK14 (0.41) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6766839 0.90 MAPK14 (0.42) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6766805 0.90 MAPK14 (0.43) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6773236 0.89 MAPK13 (0.45) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6767021 0.85 MAPK13 (0.41) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6768754 0.84 MAPK13 (0.42) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6767908 0.81 MAPK14 (0.53) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6767235 0.79 MAPK14 (0.41) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6768287 0.78 MAPK14 (0.37) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6767002 0.76 MAPK14 (0.49) MAPK13MAPK12MAPK11MAPK14

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-6677337-B2 RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, INFLAMMATORY BOWEL DISEASE, CACHEXIA, SEPTIC SHOCK, CARDIOVASCULAR AND RESPIRATORY SYSTEM DISORDERS THE PROCTER & GAMBLE COMPANY 2004-01-13 US claimed
US-20030225082-A1 1,2-dihydropyrazol-3-ones which controls inflammatory cytokines PROCTER & GAMBLE COMPANY, THE 2003-12-04 US claimed

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-20030225082-A1 1,2-dihydropyrazol-3-ones which controls inflammatory cytokines IL1B, IL1A, IL1R1 MAPK13 1053/4885MAPK12 997/4885MAPK11 998/4885

“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.