SCHEMBL7540075

SCHEMBL7540075

COc1ccc(NS(=O)(=O)c2ccc(NS(C)(=O)=O)c([N+](=O)[O-])c2)cc1O

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.57
POLB P06746 3/20 0.55
L3MBTL1 Q9Y468 5/20 0.52
SMN1; SMN2 Q16637 5/20 0.50
LMNA P02545 5/20 0.50
MAPK1 P28482 4/20 0.50
HTT P42858 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
ALDH3A1 P30838 1/20 0.48
PKM P14618 1/20 0.47
HPGD P15428 2/20 0.47
MAPT P10636 6/20 0.47
TDP1 Q9NUW8 5/20 0.47
GAA P10253 2/20 0.47
DNMT1 P26358 1/20 0.45
DNMT3A Q9Y6K1 1/20 0.45

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
SCHEMBL7535636 0.89 ALDH1A1 (0.59) ALDH1A1POLBL3MBTL1SMN1; SMN2LMNA
SCHEMBL6679357 0.88 ALDH1A1 (0.53) ALDH1A1POLBL3MBTL1SMN1; SMN2LMNA
SCHEMBL7534716 0.88 ALDH1A1 (0.63) ALDH1A1POLBL3MBTL1SMN1; SMN2LMNA
SCHEMBL7534865 0.87 ALDH1A1 (0.55) ALDH1A1POLBL3MBTL1SMN1; SMN2LMNA
SCHEMBL7540247 0.86 ALDH1A1 (0.48) ALDH1A1POLBL3MBTL1SMN1; SMN2LMNA
SCHEMBL6681330 0.84 ALDH1A1 (0.59) ALDH1A1POLBL3MBTL1SMN1; SMN2LMNA
SCHEMBL6675569 0.84 ALDH1A1 (0.59) ALDH1A1POLBL3MBTL1SMN1; SMN2LMNA
SCHEMBL6674654 0.84 ALDH1A1 (0.59) ALDH1A1POLBL3MBTL1SMN1; SMN2LMNA
SCHEMBL7536287 0.83 ALDH3A1 (0.65) ALDH1A1POLBL3MBTL1SMN1; SMN2LMNA
SCHEMBL6674434 0.83 ALDH1A1 (0.60) ALDH1A1POLBL3MBTL1SMN1; SMN2LMNA

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-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents AMGEN INC. 2002-01-31 US claimed
EP-1005453-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK, INC. (US) 2000-06-07 EP claimed
WO-1999010320-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK INC. (US) 1999-03-04 WO 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-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents CYP46A1, TGFB1, NR1H2 ALDH1A1 1173/4885POLB 638/4885L3MBTL1 1938/4885

“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.