SCHEMBL4181929

SCHEMBL4181929

COc1ccc(S(=O)(=O)N(C)CCN(C)S(=O)(=O)c2ccc3c(c2)OCCN3C)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.49
▸ HTT P42858 3/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ GHSR Q92847 1/20 0.48
▸ SIGMAR1 Q99720 1/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ PDE10A Q9Y233 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ TSHR P16473 2/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ PDE4D Q08499 2/20 0.43
▸ PTGES2 Q9H7Z7 1/20 0.43
▸ SCN9A Q15858 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ HDAC3 O15379 1/20 0.42
▸ HDAC4 P56524 1/20 0.42

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
SCHEMBL4190652 0.83 ALDH1A1 (0.67) ALDH1A1HTTL3MBTL1SMN1; SMN2KMT2A
SCHEMBL4174504 0.81 ALDH1A1 (0.61) ALDH1A1HTTL3MBTL1SMN1; SMN2SIGMAR1
SCHEMBL4176914 0.79 PDE4D (0.61) ALDH1A1HTTL3MBTL1SMN1; SMN2SIGMAR1
SCHEMBL13290908 0.74 ALDH1A1 (0.57) ALDH1A1HTTGHSRKMT2APDE10A
SCHEMBL4194071 0.72 PDE4D (0.58) ALDH1A1HTTSMN1; SMN2SIGMAR1KMT2A
SCHEMBL303999 0.72 HTT (0.61) ALDH1A1HTTL3MBTL1GHSRKMT2A
SCHEMBL13246315 0.72 HTT (0.61) ALDH1A1HTTL3MBTL1GHSRKMT2A
SCHEMBL7205749 0.72 PDE4D (0.57) ALDH1A1HTTL3MBTL1SMN1; SMN2SIGMAR1
SCHEMBL4190701 0.71 PDE4D (0.54) ALDH1A1HTTL3MBTL1SMN1; SMN2SIGMAR1
SCHEMBL4187978 0.71 PDE4D (0.54) ALDH1A1HTTL3MBTL1SMN1; SMN2SIGMAR1

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 9 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
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 669/4885HTT 935/4885L3MBTL1 4391/4885

“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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