SCHEMBL6779431

SCHEMBL6779431

CCOCn1nnc(-c2ccc(F)cc2)c1-c1ccnc(Oc2cccc(Cl)c2)n1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.53
BRD4 O60885 1/20 0.46
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP1A2 P05177 3/20 0.43
CYP2C9 P11712 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HSD17B10 Q99714 2/20 0.43
CYP3A4 P08684 1/20 0.43
HPGD P15428 1/20 0.43
MEN1 O00255 2/20 0.41
USP2 O75604 2/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HIF1A Q16665 1/20 0.41
PDE10A Q9Y233 1/20 0.41

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
SCHEMBL6774295 0.92 MAPK14 (0.55) MAPK14BRD4PDE10A
SCHEMBL6773931 0.91 MAPK14 (0.54) MAPK14BRD4PDE10A
SCHEMBL6778611 0.90 MAPK14 (0.53) MAPK14BRD4PDE10A
SCHEMBL6774535 0.89 MAPT (0.57) MAPK14BRD4MAPTL3MBTL1
SCHEMBL6624696 0.89 MAPK14 (0.57) MAPK14BRD4MAPTL3MBTL1
SCHEMBL6772274 0.88 MAPK14 (0.60) MAPK14BRD4MAPTL3MBTL1
SCHEMBL6779687 0.88 MAPK14 (0.51) MAPK14BRD4PDE10A
SCHEMBL6769833 0.87 MAPK14 (0.51) MAPK14BRD4
SCHEMBL6775292 0.86 MAPK14 (0.51) MAPK14BRD4PDE10A
SCHEMBL6768581 0.86 MAPK14 (0.44) MAPK14BRD4MAPTL3MBTL1CYP1A2

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-20030013712-A1 Triazole compounds useful in treating diseases associated with unwanted cytokine activity PROCTER & GAMBLE COMPANY, THE 2003-01-16 US claimed
US-6727364-B2 ANTIINFLAMMATORY AGENTS THE PROCTER & GAMBLE COMPANY 2004-04-27 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-20030013712-A1 Triazole compounds useful in treating diseases associated with unwanted cytokine activity IL4, IL1A, IL2 MAPK14 3429/4885BRD4 389/4885MAPT 4604/4885

“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.