SCHEMBL4190652

SCHEMBL4190652

COc1ccc(S(=O)(=O)N(C)CCN(C)S(=O)(=O)c2ccc3c(c2)OCCO3)cc1OC

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.67
▸ L3MBTL1 Q9Y468 3/20 0.67
▸ HTT P42858 3/20 0.67
▸ SMN1; SMN2 Q16637 2/20 0.67
▸ HPGD P15428 1/20 0.60
▸ KMT2A Q03164 3/20 0.58
▸ MAPT P10636 3/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ HSD17B10 Q99714 1/20 0.58
▸ LMNA P02545 2/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ ATM Q13315 1/20 0.51
▸ GAA P10253 3/20 0.51
▸ USP2 O75604 2/20 0.51
▸ PKM P14618 2/20 0.51
▸ PDE4D Q08499 2/20 0.49
▸ HSP90AA1 P07900 1/20 0.49
▸ HSP90AB1 P08238 1/20 0.49

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
SCHEMBL4174504 0.95 ALDH1A1 (0.61) ALDH1A1L3MBTL1HTTSMN1; SMN2HPGD
SCHEMBL4176914 0.85 PDE4D (0.61) ALDH1A1L3MBTL1HTTSMN1; SMN2KMT2A
SCHEMBL4181929 0.83 ALDH1A1 (0.49) ALDH1A1L3MBTL1HTTSMN1; SMN2HPGD
SCHEMBL4194071 0.79 PDE4D (0.58) ALDH1A1HTTSMN1; SMN2KMT2AMAPT
SCHEMBL7205749 0.78 PDE4D (0.57) ALDH1A1L3MBTL1HTTSMN1; SMN2KMT2A
SCHEMBL4187978 0.78 PDE4D (0.54) ALDH1A1L3MBTL1HTTSMN1; SMN2KMT2A
SCHEMBL4190701 0.78 PDE4D (0.54) ALDH1A1L3MBTL1HTTSMN1; SMN2KMT2A
SCHEMBL4190670 0.77 PKM (0.81) ALDH1A1L3MBTL1HTTKMT2AMAPT
SCHEMBL4191273 0.76 TSHR (0.52) ALDH1A1HTTSMN1; SMN2HSD17B10LMNA
SCHEMBL7204075 0.76 PDE4D (0.55) ALDH1A1L3MBTL1HTTKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069302-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-03-12 — — US claimed
EP-1976498-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2008-10-08 — — EP claimed
WO-2007127505-A2 USE OF SULFONAMIDE DERIVATIVES IN THE TREATMENT OF DISORDERS OF THE METABOLISM AND THE NERVOUS SYSTEM SMITHKLINE BEECHAM CORPORATION (US) 2007-11-08 — — WO claimed
US-20090069302-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-03-12 — — US disclosed
US-20090069302-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-03-12 — — US disclosed
US-20090069302-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-03-12 — — US disclosed
EP-1976498-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2008-10-08 — — EP disclosed
WO-2007127505-A2 USE OF SULFONAMIDE DERIVATIVES IN THE TREATMENT OF DISORDERS OF THE METABOLISM AND THE NERVOUS SYSTEM SMITHKLINE BEECHAM CORPORATION (US) 2007-11-08 — — 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 (1 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-20090069302-A1 CHEMICAL COMPOUNDS TBXA2R, PDE4D, PDE4A ALDH1A1 669/4885L3MBTL1 4391/4885HTT 935/4885

“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.

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