SCHEMBL7540459

SCHEMBL7540459

COc1ccc(S(=O)(=O)c2cc(C(=O)O)c(F)c(F)c2F)cc1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 1/20 0.42
KDM4E B2RXH2 3/20 0.42
MAPK1 P28482 3/20 0.41
POLB P06746 1/20 0.41
TSHR P16473 1/20 0.41
PTGS1 P23219 1/20 0.40
PKM P14618 1/20 0.40
GAA P10253 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
PDE4D Q08499 1/20 0.38
FABP4 P15090 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PHLPP2 Q6ZVD8 1/20 0.38
PIM1 P11309 1/20 0.38
CLK1 P49759 1/20 0.38
DYRK2 Q92630 1/20 0.38

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
SCHEMBL7533111 0.89 MAPK1 (0.48) TUBB1KDM4EMAPK1POLBTSHR
SCHEMBL7537174 0.84 TUBB1 (0.52) TUBB1MAPK1POLBTSHRPTGS1
SCHEMBL7540076 0.82 PKM (0.49) POLBPKMGAA
SCHEMBL6676924 0.80 FABP4 (0.54) TSHRGAAKMT2AMEN1ALDH1A1
SCHEMBL7535465 0.78 TUBB1 (0.50) TUBB1MAPK1POLBTSHRPTGS1
SCHEMBL7534412 0.74 TUBB1 (0.60) TUBB1MAPK1POLBTSHRPTGS1
SCHEMBL7533779 0.74 HPGD (0.43) KDM4EPOLBKMT2AMEN1ALDH1A1
SCHEMBL7540138 0.73 TUBB1 (0.49) TUBB1MAPK1POLBTSHRPTGS1
SCHEMBL7534746 0.73 TUBB1 (0.45) TUBB1MAPK1POLBTSHRPTGS1
SCHEMBL7534009 0.72 TUBB1 (0.44) TUBB1MAPK1POLBTSHRPTGS1

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 TUBB1 446/4885KDM4E 2230/4885MAPK1 263/4885

“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.