SCHEMBL6676083

SCHEMBL6676083

COc1ccc(NS(=O)(=O)c2c(F)c(F)c(F)c(Br)c2F)cc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
CA1 P00915 5/20 0.44
CA2 P00918 5/20 0.44
LMNA P02545 9/20 0.43
SMN1; SMN2 Q16637 6/20 0.43
HTT P42858 5/20 0.43
ALDH1A1 P00352 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 2/20 0.41
THRB P10828 2/20 0.41
PKM P14618 1/20 0.41
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
GAA P10253 1/20 0.40
ALOX12 P18054 1/20 0.40
CRHBP P24387 1/20 0.40

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
SCHEMBL6681264 0.97 HTR6 (0.47) HTR6L3MBTL1CA1CA2LMNA
SCHEMBL6673905 0.94 HTR6 (0.49) HTR6L3MBTL1CA1CA2LMNA
SCHEMBL6089371 0.92 CA1 (0.50) L3MBTL1CA1CA2LMNASMN1; SMN2
SCHEMBL6086613 0.91 CA1 (0.49) HTR6L3MBTL1CA1CA2LMNA
SCHEMBL6088076 0.91 CA1 (0.49) HTR6L3MBTL1CA1CA2LMNA
SCHEMBL6681299 0.89 SMN1; SMN2 (0.56) HTR6CA1CA2LMNASMN1; SMN2
Batabulin SCHEMBL7103854 0.88 LMNA (0.48) HTR6L3MBTL1CA1CA2LMNA
SCHEMBL6673920 0.88 HTR6 (0.50) HTR6CA1CA2LMNASMN1; SMN2
SCHEMBL6677326 0.86 LMNA (0.58) HTR6LMNASMN1; SMN2HTTALDH1A1
SCHEMBL6675555 0.85 LMNA (0.48) L3MBTL1CA1CA2LMNASMN1; SMN2

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 9 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
EP-1005453-B1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE LOWERING AGENTS TULARIK INC (US) 2004-10-27 EP disclosed
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 HTR6 4459/4885L3MBTL1 1938/4885CA1 4659/4885

“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.