SCHEMBL6801637

SCHEMBL6801637

COc1ccc(N(Cc2ccccc2)S(=O)(=O)c2ccc(F)cc2)cc1OC

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 3/20 0.63
PGR P06401 2/20 0.60
ALDH1A1 P00352 1/20 0.60
LMNA P02545 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
KEAP1 Q14145 3/20 0.54
NFE2L2 Q16236 3/20 0.54
CNR1 P21554 2/20 0.54
CNR2 P34972 2/20 0.54
HIF1A Q16665 3/20 0.53
EPAS1 Q99814 2/20 0.53
EP300 Q09472 1/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
TAS2R14 Q9NYV8 1/20 0.52
MAPT P10636 1/20 0.51

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
SCHEMBL6803295 0.80 CNR2 (0.59) NR3C1PGRALDH1A1LMNANPSR1
SCHEMBL6962920 0.80 NR3C1 (0.68) NR3C1PGRALDH1A1LMNANPSR1
SCHEMBL14470046 0.79 KMT2A (0.56) NR3C1PGRALDH1A1LMNANPSR1
SCHEMBL6799209 0.78 MAPT (0.52) ALDH1A1KEAP1NFE2L2MEN1KMT2A
SCHEMBL6865614 0.77 ALDH1A1 (0.64) NR3C1PGRALDH1A1LMNANPSR1
SCHEMBL6806676 0.76 HIF1A (0.55) NR3C1PGRALDH1A1LMNANPSR1
SCHEMBL7420825 0.76 PDE4D (0.62) HIF1AEPAS1EP300TAS2R14MAPT
SCHEMBL398861 0.75 KEAP1 (0.70) KEAP1NFE2L2MEN1KMT2AMAPT
SCHEMBL2192252 0.75 LMNA (0.71) NR3C1ALDH1A1LMNAMEN1KMT2A
SCHEMBL3380874 0.74 NR3C1 (0.54) NR3C1KEAP1NFE2L2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2334637-B1 NOVEL POTASSIUM CHANNEL BLOCKERS JAPAN TOBACCO INC (JP) 2017-01-04 EP claimed
US-6743787-B2 FOR THERAPY OF METABOLIC DISORDERS MEDIATED BY INSULIN RESISTANCE OR HYPERGLYCEMIA IN A MAMMAL WYETH 2004-06-01 US disclosed
US-20030027795-A1 N-(4-sulfonylaryl)cyclylamine-2-hydroxyethylamines as beta-3 adrenergic receptor agonists WYETH 2003-02-06 US disclosed
US-6444685-B1 THERAPY FOR METABOLISM DISEASES; DIETETICS; ANTIDIABETIC AGENTS WYETH 2002-09-03 US disclosed
US-20020028797-A1 N-(4-sulfonylaryl)Cyclylamine 2-hydroxyethylamines as beta-3 adrenergic receptor agonists AMERICAN HOME PRODUCTS CORPORATION 2002-03-07 US disclosed
WO-2002006274-A1 N-(4-SULFONYLARYL)CYCLYLAMINE-2-HYDROXYETHYLAMINES AS BETA-3 ADRENERGIC RECEPTOR AGONISTS WYETH (US) 2002-01-24 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 (2 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-20030027795-A1 N-(4-sulfonylaryl)cyclylamine-2-hydroxyethylamines as beta-3 adrenergic receptor agonists ADRB3, ADRB1, ADRB2 NR3C1 142/4885PGR 3274/4885ALDH1A1 2253/4885
US-20020028797-A1 N-(4-sulfonylaryl)Cyclylamine 2-hydroxyethylamines as beta-3 adrenergic receptor agonists ADRB3, ADRB1, ADRB2 NR3C1 157/4885PGR 3399/4885ALDH1A1 1800/4885

“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.