SCHEMBL7537091

SCHEMBL7537091

COc1ccc(CS(=O)(=O)c2c(F)cc(F)c(F)c2F)cc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
TSHR P16473 1/20 0.47
NFKB1 P19838 1/20 0.47
TUBB1 Q9H4B7 4/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
APEX1 P27695 1/20 0.46
KMT2A Q03164 1/20 0.46
GAA P10253 1/20 0.46
ALOX15 P16050 1/20 0.43
ALOX12 P18054 1/20 0.43
TUBB4A P04350 3/20 0.42
TUBB P07437 3/20 0.42
TUBA3C P0DPH7 3/20 0.42
TUBA1B P68363 3/20 0.42
TUBA4A P68366 3/20 0.42
TUBB4B P68371 3/20 0.42
TUBB3 Q13509 3/20 0.42
TUBB2A Q13885 3/20 0.42

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
SCHEMBL7534408 0.89 GAA (0.50) CYP1A2CYP3A4TSHRNFKB1TUBB1
SCHEMBL7533183 0.84 GAA (0.45) CYP1A2CYP3A4TSHRNFKB1TUBB1
SCHEMBL29665700 0.78 TUBB1 (0.43) TUBB1LMNAALDH1A1
SCHEMBL7535556 0.78 TUBB1 (0.43) TUBB1LMNAALDH1A1
SCHEMBL24458182 0.78 HTT (0.41) TUBB1MEN1LMNAKMT2AALDH1A1
SCHEMBL7540460 0.76 CA2 (0.49) TSHRMEN1LMNAKMT2AGAA
SCHEMBL7537113 0.74 LMNA (0.50) TSHRTUBB1MEN1LMNAKMT2A
SCHEMBL29665751 0.74 TUBB1 (0.39) TUBB1LMNAALDH1A1
SCHEMBL24458142 0.74 TUBB1 (0.39) TUBB1LMNAALDH1A1
SCHEMBL7535509 0.72 VCAM1 (0.47) CYP1A2CYP3A4TSHRNFKB1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6388131-B2 Benzenesulfonamide compounds, which encompasses the compound batabulin (2-Fluoro-1-methoxy-4-pentafluorophenylsulfonamidobenzene) TULARIK, INC. 2002-05-14 US disclosed
US-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents AMGEN INC. 2002-01-31 US disclosed
US-6284923-B1 BENZENESULFONIMIDES FOR TREATMENT OF CANCER AND ANTICHOLESTEROL AGENTS TULARIK INC 2001-09-04 US disclosed
EP-1005453-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK, INC. (US) 2000-06-07 EP disclosed
WO-1999010320-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK INC. (US) 1999-03-04 WO disclosed

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 CYP1A2 503/4885CYP3A4 725/4885TSHR 4093/4885

“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.