SCHEMBL10034973

SCHEMBL10034973

COc1cc(NC(=O)c2ccc(-c3cccc4c3C(=O)CC4)cc2)ccc1S(N)(=O)=O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.46
▸ KLK7 P49862 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ MAPT P10636 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ NAMPT P43490 2/20 0.43
▸ PLAU P00749 1/20 0.43
▸ PLAT P00750 1/20 0.43
▸ MAPK14 Q16539 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MCHR1 Q99705 1/20 0.42

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
SCHEMBL10035051 0.80 MCHR1 (0.49) STAT3KLK7MAPTPOLBPLAU
SCHEMBL10035032 0.80 MAPT (0.49) STAT3KLK7KDM4ESMN1; SMN2MAPT
SCHEMBL10035266 0.79 MCHR1 (0.49) STAT3KLK7MAPTPOLBPLAU
SCHEMBL10035061 0.78 F10 (0.47) STAT3KLK7GAASMN1; SMN2MAPT
SCHEMBL10035033 0.77 NPC1 (0.47) STAT3KLK7KDM4EALDH1A1MAPT
SCHEMBL10035265 0.76 HTR1D (0.52) STAT3KLK7KDM4EALDH1A1MAPK1
SCHEMBL10035001 0.75 STAT3 (0.55) STAT3KLK7ALDH1A1GAAMAPK1
SCHEMBL10035062 0.75 ABCB1 (0.55) STAT3KLK7ALDH1A1GAASMN1; SMN2
SCHEMBL14930255 0.73 STAT3 (0.53) STAT3KLK7ALDH1A1SMN1; SMN2HPGD
SCHEMBL10034976 0.73 S1PR1 (0.47) STAT3KLK7KDM4EALDH1A1GAA

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-20130116227-A1 BIARYL AMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-05-09 — — US disclosed
WO-2012008435-A1 BIARYL AMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF 大日本住友製薬株式会社 (JP) 2012-01-19 — — WO 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-20130116227-A1 BIARYL AMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF MC2R, NR3C2, REN STAT3 690/4885KLK7 2190/4885KDM4E 2925/4885

“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.

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