SCHEMBL7535491

SCHEMBL7535491

COc1ccc(S(=O)(=O)c2c(F)c(F)c(OC(C)=O)c([N+](=O)[O-])c2F)cc1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEP1B Q16820 1/20 0.42
ALDH1A1 P00352 5/20 0.39
VCP P55072 1/20 0.38
KMT2A Q03164 5/20 0.38
LMNA P02545 3/20 0.38
NAMPT P43490 2/20 0.38
MAPT P10636 3/20 0.37
HTT P42858 3/20 0.37
GAA P10253 3/20 0.37
MITF O75030 1/20 0.37
PKM P14618 1/20 0.37
POLB P06746 3/20 0.36
KDM4E B2RXH2 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 2/20 0.36
TUBB1 Q9H4B7 2/20 0.36
HPGD P15428 1/20 0.36
TUBB4A P04350 1/20 0.36

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
SCHEMBL7540179 0.91 ALDH1A1 (0.39) ALDH1A1VCPKMT2ALMNAMAPT
SCHEMBL7540068 0.85 ALDH1A1 (0.44) MEP1BALDH1A1KMT2ALMNAMAPT
SCHEMBL7542288 0.84 PKM (0.43) ALDH1A1KMT2ALMNAMAPTHTT
SCHEMBL7536227 0.84 KMT2A (0.45) MEP1BALDH1A1KMT2APOLBKDM4E
SCHEMBL7540055 0.78 ALDH1A1 (0.43) ALDH1A1KMT2ALMNAMAPTHTT
SCHEMBL7538200 0.78 MEP1B (0.46) MEP1BKMT2ALMNANAMPTHTT
SCHEMBL7535778 0.77 MAPK1 (0.53) MEP1BKMT2ALMNAHTTPOLB
SCHEMBL7536222 0.75 ALDH1A1 (0.43) ALDH1A1VCPKMT2ALMNAMAPT
SCHEMBL7535500 0.73 ALDH1A1 (0.43) ALDH1A1KMT2ALMNAMAPTHTT
SCHEMBL7533758 0.72 MEP1B (0.50) MEP1BKMT2ALMNAHTTPOLB

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-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents AMGEN INC. 2002-01-31 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-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents CYP46A1, TGFB1, NR1H2 MEP1B 2987/4885ALDH1A1 1173/4885VCP 2842/4885

“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.