SCHEMBL6802663

SCHEMBL6802663

O=C1CCN(c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.67
LMNA P02545 3/20 0.64
USP2 O75604 1/20 0.61
AKR1C3 P42330 1/20 0.59
KMT2A Q03164 2/20 0.58
POLB P06746 1/20 0.57
MEN1 O00255 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.55
TSHR P16473 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
ALDH1A1 P00352 2/20 0.51
GAA P10253 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
SCHEMBL6801727 0.98 MAPT (0.65) MAPTLMNAUSP2AKR1C3KMT2A
SCHEMBL10445165 0.86 USP2 (0.77) MAPTLMNAUSP2AKR1C3KMT2A
SCHEMBL6803820 0.86 KMT2A (0.60) LMNAUSP2KMT2APOLBMEN1
SCHEMBL19392491 0.81 POLB (0.80) MAPTLMNAUSP2KMT2APOLB
SCHEMBL2836378 0.80 MAPT (0.67) MAPTLMNAUSP2AKR1C3KMT2A
SCHEMBL31322362 0.79 MAPT (0.65) MAPTLMNAUSP2AKR1C3KMT2A
SCHEMBL2831624 0.78 MAPT (0.63) MAPTLMNAUSP2AKR1C3KMT2A
SCHEMBL10395197 0.77 AKR1C3 (0.53) LMNAAKR1C3KMT2AMEN1SMN1; SMN2
SCHEMBL17893606 0.77 ALDH1A1 (0.64) LMNAPOLBALDH1A1
SCHEMBL6802924 0.77 MEN1 (0.57) MAPTUSP2KMT2AMEN1TSHR

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 4140/4885LMNA 1552/4885USP2 4320/4885
US-20020028797-A1 N-(4-sulfonylaryl)Cyclylamine 2-hydroxyethylamines as beta-3 adrenergic receptor agonists ADRB3, ADRB1, ADRB2 MAPT 4309/4885LMNA 1464/4885USP2 4239/4885

“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.