SCHEMBL7540247

SCHEMBL7540247

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
MAPT P10636 6/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 3/20 0.47
GAA P10253 2/20 0.47
ABCB1 P08183 1/20 0.46
CYP19A1 P11511 6/20 0.44
MEN1 O00255 2/20 0.44
MAPK1 P28482 5/20 0.43
LMNA P02545 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MLNR O43193 1/20 0.43
MMP1 P03956 1/20 0.43
MPO P05164 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL7534762 0.86 L3MBTL1 (0.58) ALDH1A1MAPTKMT2APOLBGAA
SCHEMBL7540163 0.86 MAPT (0.48) ALDH1A1MAPTKMT2APOLBGAA
SCHEMBL7540075 0.86 ALDH1A1 (0.57) ALDH1A1MAPTKMT2APOLBGAA
SCHEMBL7541187 0.86 VCAM1 (0.49) ALDH1A1MAPTKMT2APOLBCYP19A1
SCHEMBL7533072 0.83 POLB (0.50) ALDH1A1MAPTKMT2APOLBGAA
SCHEMBL7537195 0.83 ALDH3A1 (0.56) ALDH1A1MAPTKMT2APOLBGAA
SCHEMBL7540386 0.80 VCAM1 (0.66) ALDH1A1MAPTKMT2APOLBGAA
SCHEMBL8026964 0.78 ABCC9 (0.57) ALDH1A1MAPTKMT2APOLBCYP19A1
SCHEMBL7535636 0.76 ALDH1A1 (0.59) ALDH1A1MAPTKMT2APOLBGAA
SCHEMBL7534865 0.75 ALDH1A1 (0.55) ALDH1A1MAPTKMT2APOLBGAA

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 1173/4885MAPT 2283/4885KMT2A 3154/4885

“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.