SCHEMBL6799462

SCHEMBL6799462

COC(=O)N(CC(=O)O)S(=O)(=O)c1ccc(N2CCC(=O)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 3/20 0.39
RAB9A P51151 1/20 0.39
GAA P10253 1/20 0.39
RORC P51449 4/20 0.39
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
CNR1 P21554 2/20 0.38
CNR2 P34972 2/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL7524204 0.99 MAPT (0.42) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL7524192 0.98 MAPT (0.41) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL6796417 0.82 KMT2A (0.56) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL6801269 0.80 RORC (0.45) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL6802888 0.76 NR1D1 (0.41) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL6800336 0.72 NR1D1 (0.44) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL6800301 0.72 KMT2A (0.51) KMT2AMEN1SMN1; SMN2HPGDALDH1A1
SCHEMBL6797196 0.71 GAA (0.54) KMT2AMEN1SMN1; SMN2ALDH1A1GAA
SCHEMBL6801622 0.71 ALDH1A1 (0.57) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL6800428 0.70 MEN1 (0.43) KMT2AMEN1SMN1; SMN2HPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MAPT 4140/4885KMT2A 1041/4885MEN1 2627/4885
US-20020028797-A1 N-(4-sulfonylaryl)Cyclylamine 2-hydroxyethylamines as beta-3 adrenergic receptor agonists ADRB3, ADRB1, ADRB2 MAPT 4309/4885KMT2A 906/4885MEN1 2724/4885

“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.