SCHEMBL6769766

SCHEMBL6769766

CCOCn1nnc(-c2ccc(F)cc2)c1-c1cnc(Oc2ccccc2)n1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.54
ALDH1A1 P00352 7/20 0.41
HSD17B10 Q99714 6/20 0.41
CYP1A2 P05177 6/20 0.41
TSHR P16473 5/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
CYP3A4 P08684 3/20 0.41
HPGD P15428 2/20 0.41
SCN9A Q15858 4/20 0.39
USP2 O75604 4/20 0.37
CYP2C9 P11712 1/20 0.37
MAPK1 P28482 2/20 0.35
GAA P10253 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
ALOX15 P16050 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPK13 O15264 2/20 0.34
MAPK12 P53778 2/20 0.34

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
SCHEMBL6773031 0.92 MAPK14 (0.54) MAPK14ALDH1A1HSD17B10CYP1A2TSHR
SCHEMBL6645694 0.80 GAA (0.61) MAPK14ALDH1A1HSD17B10CYP1A2TSHR
SCHEMBL6617172 0.80 MAPK14 (0.52) MAPK14ALDH1A1HSD17B10CYP1A2TSHR
SCHEMBL6603309 0.79 ATP1A1 (0.56) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6889077 0.79 MAPK14 (0.54) MAPK14ALDH1A1HSD17B10CYP1A2TSHR
SCHEMBL6774297 0.77 MAPK14 (0.54) MAPK14ALDH1A1HSD17B10CYP1A2TSHR
SCHEMBL6624696 0.77 MAPK14 (0.57) MAPK14SCN9AL3MBTL1MAPT
SCHEMBL6773933 0.75 MAPK14 (0.54) MAPK14ALDH1A1HSD17B10CYP1A2TSHR
SCHEMBL6774345 0.74 MAPK14 (0.53) MAPK14ALDH1A1HSD17B10CYP1A2TSHR
SCHEMBL6774342 0.74 MAPK14 (0.53) MAPK14ALDH1A1HSD17B10CYP1A2TSHR

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 3 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
US-20030013712-A1 Triazole compounds useful in treating diseases associated with unwanted cytokine activity PROCTER & GAMBLE COMPANY, THE 2003-01-16 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 3429/4885ALDH1A1 289/4885HSD17B10 805/4885

“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.