SCHEMBL6987366

SCHEMBL6987366

O=S(=O)(Cl)c1cccc2oc3ccccc3c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.45
ALDH1A1 P00352 3/20 0.45
GLA P06280 2/20 0.45
KDM4E B2RXH2 2/20 0.45
HPGD P15428 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HSD17B10 Q99714 2/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
PGAM1 P18669 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
HDAC1 Q13547 2/20 0.44
AHR P35869 2/20 0.43
CDC14B O60729 1/20 0.41
CDC14A Q9UNH5 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
BCAT1 P54687 1/20 0.37
GABRP O00591 1/20 0.37

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
SCHEMBL7943736 0.88 MAOA (0.56) MAOAALDH1A1GLAKDM4EHPGD
SCHEMBL27834031 0.85 ALDH1A1 (0.48) MAOAALDH1A1GLAKDM4EHPGD
SCHEMBL329795 0.83 ALDH1A1 (0.47) MAOAALDH1A1GLAKDM4EHPGD
SCHEMBL4907475 0.83 CA1 (0.55) MAOAALDH1A1GLAKDM4EHPGD
SCHEMBL29945034 0.81 MAOA (0.47) MAOAALDH1A1GLAKDM4EHPGD
SCHEMBL329796 0.81 MAOA (0.47) MAOAALDH1A1GLAKDM4EHPGD
Dibenzofuran SCHEMBL6987363 0.78 MAOA (0.58) MAOAALDH1A1GLAKDM4EHPGD
SCHEMBL22011703 0.77 CDC14B (0.49) MAOAALDH1A1GLAKDM4EHPGD
SCHEMBL5016444 0.74 MAOA (0.50) MAOAALDH1A1GLAKDM4EHPGD
SCHEMBL28983201 0.73 CYP2A6 (0.49) MAOAALDH1A1GLAKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6649603-B2 For therapy of metabolic disorders related to insulin resistance or hyperglycemia WYETH 2003-11-18 US disclosed
EP-1328512-A2 CYCLYLAMINE SULFONAMIDES AS BETA-3 ADRENERGIC RECEPTOR AGONISTS Wyeth (US) 2003-07-23 EP disclosed
US-20030027797-A1 Cyclylamine sulfonamides as beta-3 adrenergic receptor agonists WYETH (US) 2003-02-06 US disclosed
US-6498170-B2 4-((2S)-3-(1-(4-BUTOXY-BENZENESULFONYL)-AZETIDIN-3-YLAMINO)-2 -HYDROXY- PROPOXY)-PHENOL FOR EXAMPLE; HYPOGLYCEMIC AGENT; INCREASING LEAN MEAT TO FAT RATIO IN MAMMALS WYETH 2002-12-24 US disclosed
US-20020077455-A1 Protease inhibitors SMITHKLINE BEECHAM CORPORATION 2002-06-20 US disclosed
US-20020022605-A1 Cyclamine sulfonamides as beta-3 adrenergic receptor agonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-02-21 US disclosed
WO-2002006221-A2 CYCLYLAMINE SULFONAMIDES 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 (3 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-20020022605-A1 Cyclamine sulfonamides as beta-3 adrenergic receptor agonists ADRB3, ADRB1, ADRB2 MAOA 3669/4885ALDH1A1 3013/4885GLA 2471/4885
US-20030027797-A1 Cyclylamine sulfonamides as beta-3 adrenergic receptor agonists ADRB3, ADRB1, ADRB2 MAOA 3407/4885ALDH1A1 2651/4885GLA 2474/4885
US-20020077455-A1 Protease inhibitors CTSK, CTSZ, CTSG MAOA 3330/4885ALDH1A1 3948/4885GLA 43/4885

“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.