SCHEMBL1207409

SCHEMBL1207409

O=S(=O)(Nc1cccc2cc[nH]c12)c1cccnc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 8/20 0.62
GLO1 Q04760 2/20 0.62
NR3C1 P04150 1/20 0.56
PGR P06401 1/20 0.56
NR3C2 P08235 1/20 0.56
AR P10275 1/20 0.56
BRAF P15056 1/20 0.48
G6PD P11413 1/20 0.46
NFKBIA P25963 1/20 0.46
AGTR1 P30556 1/20 0.46
METAP2 P50579 1/20 0.46
METAP1 P53582 1/20 0.46
PAX8 Q06710 1/20 0.46
ATM Q13315 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
BRD4 O60885 1/20 0.46
ATR Q13535 1/20 0.45
NAMPT P43490 2/20 0.44
KMT2A Q03164 1/20 0.44
CKS1B P61024 3/20 0.44

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
SCHEMBL2367383 0.83 NR3C1 (0.65) SLC40A1GLO1NR3C1PGRNR3C2
SCHEMBL3060588 0.80 GAA (0.57) SLC40A1GLO1NR3C1PGRNR3C2
SCHEMBL3066019 0.77 SLC40A1 (0.57) SLC40A1NR3C1PGRNR3C2AR
SCHEMBL2367682 0.77 NR3C1 (0.64) SLC40A1NR3C1PGRNR3C2AR
SCHEMBL30925462 0.77 SLC40A1 (1.00) SLC40A1GLO1G6PDNFKBIAAGTR1
SCHEMBL2367735 0.77 NR3C1 (0.60) SLC40A1NR3C1PGRNR3C2AR
SCHEMBL1984869 0.77 CA1 (0.60) NR3C1PGRNR3C2ARTDP1
SCHEMBL11973652 0.77 SLC40A1 (1.00) SLC40A1GLO1G6PDNFKBIAAGTR1
SCHEMBL2367583 0.74 NFKBIA (0.58) NR3C1PGRNR3C2ARNFKBIA
SCHEMBL3061760 0.74 NR3C1 (0.56) NR3C1PGRNR3C2ARKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210387949-A1 NEW SELECTIVE MODULATORS OF INSECT NICOTINIC ACETYLCHOLINE RECEPTORS UNIV NANTES (FR) 2021-12-16 US disclosed
CN-113631551-A Novel competitive modulators of insect nicotinic acetylcholine receptors 南特大学 2021-11-09 CN disclosed
EP-3877377-A1 NEW SELECTIVE MODULATORS OF INSECT NICOTINIC ACETYLCHOLINE RECEPTORS Universite de Nantes (FR) 2021-09-15 EP disclosed
EP-3650447-A1 NEW SELECTIVE MODULATORS OF INSECT NICOTINIC ACETYLCHOLINE RECEPTORS Universite de Nantes (FR) 2020-05-13 EP disclosed
US-7939532-B2 Heterocyclyl pyridyl sulfonamide derivatives, their manufacture and use as pharmaceutical agents HOFFMANN-LA ROCHE INC. (US) 2011-05-10 US disclosed
US-7879884-B2 6-(2-Chloro-phenyl)-5-methyl-pyridine-3-sulfonic acid 2-chloro-4-fluoro-benzoylamide; potassium salt, used as antiproliferative, anticarcinogenic or antitumor agents HOFFMANN-LA ROCHE INC. (US) 2011-02-01 US disclosed
US-20100292247-A1 HETEROCYCLYL PYRIDYL SULFONAMIDE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2010-11-18 US disclosed
US-20100256200-A1 ARYL PYRIDYL SULFONAMIDE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2010-10-07 US disclosed
EP-2148861-A1 ARYL PYRIDYL SULFONAMIDE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. Hoffmann-Roche AG (CH) 2010-02-03 EP disclosed
US-7625896-B2 Pyridylsulfonamide derivatives HOFFMAN-LA ROCHE INC. (US) 2009-12-01 US disclosed
WO-2008138594-A1 ARYL PYRIDYL SULFONAMIDE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2008-11-20 WO disclosed
EP-1960361-A1 PYRIDYLSULFONAMIDE DERIVATIVES, THEIR MANUFACTURE AND USE AS ANTINEOPLASTIC AGENTS F.HOFFMANN-LA ROCHE AG (CH) 2008-08-27 EP disclosed
WO-2007059872-A1 PYRIDYLSULFONAMIDE DERIVATIVES, THEIR MANUFACTURE AND USE AS ANTINEOPLASTIC AGENTS F. HOFFMNN-LA ROCHE AG (CH) 2007-05-31 WO disclosed
US-20070123513-A1 6-thiomorpholin-4-yl-pyridine-3-sulfonic acid 4-chloro-2-methoxy-benzoylamide; ammonium salt of3-methyl-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-sulfonic acid 4-chloro-2-methoxy-benzoylamide; anticarcinogenic agent HOFFMANN-LA ROCHE INC. 2007-05-31 US 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 (4 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-20070123513-A1 6-thiomorpholin-4-yl-pyridine-3-sulfonic acid 4-chloro-2-methoxy-benzoylamide; ammonium salt of3-methyl-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-sulfonic acid 4-chloro-2-methoxy-benzoylamide; anticarcinogenic agent TPMT, BPNT1, SLC6A3 SLC40A1 2750/4885GLO1 1104/4885NR3C1 775/4885
US-20100256200-A1 ARYL PYRIDYL SULFONAMIDE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS ARSA, STS, SULT2A1 SLC40A1 1296/4885GLO1 1605/4885NR3C1 3269/4885
US-20210387949-A1 NEW SELECTIVE MODULATORS OF INSECT NICOTINIC ACETYLCHOLINE RECEPTORS CHRM3, CHRNA3, CHRNB3 SLC40A1 3203/4885GLO1 1819/4885NR3C1 468/4885
US-20100292247-A1 HETEROCYCLYL PYRIDYL SULFONAMIDE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS STS, TPMT, DPYD SLC40A1 2677/4885GLO1 2248/4885NR3C1 4159/4885

“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.