SCHEMBL6803295

SCHEMBL6803295

COc1ccc(N(Cc2ccccc2)S(=O)(=O)c2ccc(N3CCC(=O)CC3)cc2)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.59
CNR1 P21554 3/20 0.59
HIF1A Q16665 3/20 0.55
EP300 Q09472 1/20 0.55
PGR P06401 2/20 0.51
ALDH1A1 P00352 2/20 0.51
LMNA P02545 2/20 0.51
NR3C1 P04150 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
HTR1A P08908 1/20 0.47
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
HTR7 P34969 1/20 0.47
DRD3 P35462 1/20 0.47
HTR6 P50406 1/20 0.47
EPAS1 Q99814 2/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.45
TAS2R14 Q9NYV8 1/20 0.45
HTT P42858 1/20 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
SCHEMBL6806676 0.84 HIF1A (0.55) CNR2CNR1HIF1AEP300PGR
SCHEMBL6075175 0.80 MAPT (0.47) CNR2CNR1HIF1AEP300MAPT
SCHEMBL6801637 0.80 NR3C1 (0.63) CNR2CNR1HIF1AEP300PGR
SCHEMBL303551 0.77 LMNA (0.60) CNR2CNR1HIF1AEP300ALDH1A1
SCHEMBL302099 0.76 KMT2A (0.54) CNR2CNR1LMNAHTR1AHTR2A
SCHEMBL6074918 0.74 HCRTR2 (0.53) ALDH1A1MAPTKMT2A
SCHEMBL22273620 0.73 NR3C1 (0.46) CNR2CNR1PGRALDH1A1LMNA
SCHEMBL1966437 0.72 HTR7 (0.69) CNR2CNR1ALDH1A1LMNANR3C1
SCHEMBL6801688 0.71 GAA (0.62) CNR2CNR1ALDH1A1LMNAMAPT
SCHEMBL3544939 0.70 LMNA (0.51) HIF1APGRALDH1A1LMNANR3C1

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 CNR2 60/4885CNR1 24/4885HIF1A 1343/4885
US-20020028797-A1 N-(4-sulfonylaryl)Cyclylamine 2-hydroxyethylamines as beta-3 adrenergic receptor agonists ADRB3, ADRB1, ADRB2 CNR2 42/4885CNR1 18/4885HIF1A 1286/4885

“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.