SCHEMBL7257359

SCHEMBL7257359

COc1ccc(S(=O)(=O)N(CC(C)C)c2cccc(C[C@@H](C)CNC(=O)COc3c(C)cccc3C)c2O)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
PTGER1 P34995 2/20 0.41
KEAP1 Q14145 4/20 0.40
NFE2L2 Q16236 3/20 0.40
MMP1 P03956 1/20 0.40
MMP9 P14780 1/20 0.40
MMP13 P45452 1/20 0.40
BMP1 P13497 2/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL5982918 0.92 POLB (0.44) MAPTPTGER1KEAP1NFE2L2MMP1
SCHEMBL7456019 0.87 PTGER1 (0.41) MAPTPTGER1KEAP1NFE2L2MMP1
SCHEMBL2581362 0.79 KEAP1 (0.47) KEAP1NFE2L2BMP1
SCHEMBL5026438 0.79 PTGER1 (0.38) MAPTPTGER1KEAP1NFE2L2MMP1
SCHEMBL8370091 0.77 KEAP1 (0.45) KEAP1NFE2L2MEN1KMT2A
SCHEMBL7257038 0.75 KEAP1 (0.48) MAPTKEAP1NFE2L2MMP1MMP9
SCHEMBL7447488 0.74 CYP2C9 (0.43) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL7452491 0.73 KEAP1 (0.50) KEAP1NFE2L2MMP1MMP9MMP13
SCHEMBL6395395 0.72 KEAP1 (0.36) MAPTPTGER1KEAP1NFE2L2MMP1
SCHEMBL5981554 0.71 MCL1 (0.39) MAPTMEN1KMT2ALMNA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030191319-A1 Alpha-and beta-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors G.D. SEARLE & CO. 2003-10-09 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-20030191319-A1 Alpha-and beta-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors DNPEP, ASPH, PREP MAPT 2442/4885PTGER1 3354/4885KEAP1 4367/4885

“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.