SCHEMBL6764074

SCHEMBL6764074

Cn1c(-c2ccnc(Oc3cccc(F)c3)n2)c(-c2ccc(F)cc2)c(=O)n1C

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.53
PDE10A Q9Y233 1/20 0.48
TGFBR1 P36897 2/20 0.47
MAPT P10636 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
BRD4 O60885 2/20 0.43
BRDT Q58F21 2/20 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
SCHEMBL6621979 0.91 MAPK14 (0.60) MAPK14PDE10ATGFBR1MAPTL3MBTL1
SCHEMBL6774532 0.89 MAPT (0.54) MAPK14MAPTL3MBTL1BRD4BRDT
SCHEMBL6766624 0.86 MAPK14 (0.50) MAPK14PDE10ABRD4BRDT
SCHEMBL6773835 0.85 MAPK14 (0.55) MAPK14PDE10AMAPTL3MBTL1
SCHEMBL6768263 0.85 MAPK14 (0.53) MAPK14BRD4BRDT
SCHEMBL6767002 0.85 MAPK14 (0.49) MAPK14PDE10A
SCHEMBL6768077 0.84 MAPK14 (0.65) MAPK14BRD4BRDT
SCHEMBL6764044 0.84 MAPK14 (0.65) MAPK14BRD4BRDT
SCHEMBL6767267 0.83 MAPK14 (0.51) MAPK14TGFBR1BRD4BRDT
SCHEMBL4850491 0.83 MAPK14 (0.59) MAPK14

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 MAPK14 1086/4885PDE10A 1590/4885TGFBR1 128/4885

“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.