SCHEMBL6676829

SCHEMBL6676829

O=S(=O)(Cl)c1c(F)c(F)c(F)c(F)c1Br

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
CA12 O43570 1/20 0.40
CA7 P43166 1/20 0.40
CA13 Q8N1Q1 1/20 0.40
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
MMP8 P22894 1/20 0.36
MMP13 P45452 1/20 0.36
F2 P00734 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32

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
SCHEMBL29505948 1.00 CA1 (0.40) CA1CA2CA12CA7CA13
SCHEMBL6674621 0.88 CA1 (0.39) CA1CA2CA12CA7CA13
SCHEMBL6675273 0.87 CA1 (0.36) CA1CA2CA12CA7CA13
SCHEMBL25069061 0.82 CA1 (0.31) CA1CA2CA12CA7CA13
SCHEMBL29671302 0.82 CA1 (0.31) CA1CA2CA12CA7CA13
SCHEMBL521623 0.81 CA1 (0.50) CA1CA2CA12CA7CA13
SCHEMBL31683748 0.78 CA1 (0.45) CA1CA2CA12CA7CA13
SCHEMBL6680022 0.75 CA1 (0.43) CA1CA2CA12CA7CA13
SCHEMBL25358993 0.73 CA1 (0.48) CA1CA2CA12CA7CA13
SCHEMBL25359572 0.72 CA1 (0.42) CA1CA2CA12CA7CA13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265055-A1 STAT INIHIBITORY COMPOUNDS AND COMPOSITIONS OXFORD FINANCE LLC 2023-08-24 US disclosed
US-20230265055-A1 STAT INIHIBITORY COMPOUNDS AND COMPOSITIONS OXFORD FINANCE LLC 2023-08-24 US disclosed
US-20230265055-A1 STAT INIHIBITORY COMPOUNDS AND COMPOSITIONS OXFORD FINANCE LLC 2023-08-24 US disclosed
EP-1005453-B1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE LOWERING AGENTS TULARIK INC (US) 2004-10-27 EP disclosed
EP-1090014-B1 ARYLSULFONANILIDE PHOSPHATES TULARIK INC (US) 2003-09-03 EP disclosed
US-6417176-B2 ANTICANCER AGENTS, PSORIASIS, RESTENOSIS, ATHEROSCLEROSIS TULARIK, INC. 2002-07-09 US 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
US-20010018430-A1 Arylsulfonanilide phosphates TULARIK, INC. 2001-08-30 US disclosed
EP-1090014-A1 ARYLSULFONANILIDE PHOSPHATES Tularik Inc. (US) 2001-04-11 EP disclosed
US-6211167-B1 ANTICHOLESTEROL, ANTIPROLIFERATIVE AND ANTILIPEMIC AGENTS; CANCER, PSORIASIS, ATHEROSCLEROSIS, INFECTION AND VASCULAR RESTENOSIS TREATMENT TULARIK INC. 2001-04-03 US disclosed
EP-1005453-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK, INC. (US) 2000-06-07 EP disclosed
WO-1999067258-A1 ARYLSULFONANILIDE PHOSPHATES TULARIK INC. (US) 1999-12-29 WO 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 (3 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 CA1 4659/4885CA2 3895/4885CA12 4726/4885
US-20010018430-A1 Arylsulfonanilide phosphates PIK3CA, INPP5D, INPPL1 CA1 4626/4885CA2 3068/4885CA12 4574/4885
US-20230265055-A1 STAT INIHIBITORY COMPOUNDS AND COMPOSITIONS STAT5B, STAT5A, STAT3 CA1 4704/4885CA2 4486/4885CA12 4701/4885

“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.