SCHEMBL1001249

SCHEMBL1001249

COc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)O

nearest known ligand 0.97

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.73
MCOLN3 Q8TDD5 2/20 0.69
TSHR P16473 3/20 0.67
HSD17B10 Q99714 1/20 0.67
POLB P06746 1/20 0.65
CYP3A4 P08684 1/20 0.65
TP53 P04637 1/20 0.64
ALDH1A1 P00352 2/20 0.62
GPBAR1 Q8TDU6 1/20 0.62
RXFP1 Q9HBX9 2/20 0.61
KMT2A Q03164 1/20 0.61

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
SCHEMBL8544209 0.99 APEX1 (0.75) APEX1MCOLN3TSHRHSD17B10POLB
SCHEMBL8541971 0.96 APEX1 (0.75) APEX1MCOLN3TSHRHSD17B10POLB
Ethyl Acetate SCHEMBL9031428 0.90 KMT2A (0.65) APEX1MCOLN3POLBALDH1A1KMT2A
SCHEMBL1645604 0.88 APEX1 (0.72) APEX1TSHRHSD17B10POLBTP53
SCHEMBL8540145 0.87 APEX1 (0.70) APEX1MCOLN3TSHRHSD17B10POLB
SCHEMBL8540322 0.87 POLB (0.73) APEX1POLBALDH1A1KMT2A
SCHEMBL25705600 0.83 APEX1 (0.65) APEX1MCOLN3HSD17B10POLBTP53
SCHEMBL7205052 0.83 GPBAR1 (0.88) MCOLN3TSHRHSD17B10ALDH1A1GPBAR1
SCHEMBL11167770 0.83 TSHR (0.54) APEX1MCOLN3TSHRHSD17B10POLB
SCHEMBL8545158 0.82 APEX1 (0.64) APEX1MCOLN3HSD17B10POLBTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1615904-B1 SUBSTITUTED BENZOSULPHONAMIDES AS POTENTIATORS OF GLUTAMATE RECEPTORS ASTRAZENECA AB (SE) 2008-02-27 EP claimed
EP-2280001-B1 LONG-CHAIN FATTY ACID ELONGATION ENZYME INHIBITOR COMPRISING ARYLSULFONYL DERIVATIVE AS ACTIVE INGREDIENT MSD KK (JP) 2014-10-15 EP disclosed
US-8420823-B2 Long-chain fatty acyl elongase inhibitor comprising arylsulfonyl derivative as active ingredient MSD K.K. (JP) 2013-04-16 US disclosed
EP-2280001-A1 LONG-CHAIN FATTY ACID ELONGATION ENZYME INHIBITOR COMPRISING ARYLSULFONYL DERIVATIVE AS ACTIVE INGREDIENT Banyu Pharmaceutical Co., Ltd. (JP) 2011-02-02 EP disclosed
US-20110009622-A1 LONG-CHAIN FATTY ACYL ELONGASE INHIBITOR COMPRISING ARYLSULFONYL DERIVATIVE AS ACTIVE INGREDIENT MSD K.K. (JP) 2011-01-13 US disclosed
EP-1615904-B1 SUBSTITUTED BENZOSULPHONAMIDES AS POTENTIATORS OF GLUTAMATE RECEPTORS ASTRAZENECA AB (SE) 2008-02-27 EP disclosed
US-20070021606-A1 Therapeutic compounds ASTRAZENECA AB (SE) 2007-01-25 US disclosed
EP-1615904-A2 SUBSTITUTED BENZOSULPHONAMIDE AS POTENTIATORS OF GLUTAMATE RECEPTORS AstraZeneca AB (SE) 2006-01-18 EP disclosed
WO-2004092135-A2 SUBSTITUTED BENZOSULPHONAMIDE AS POTENTIATORS OF GLUTAMATE RECEPTORS ASTRAZENECA (SE) 2004-10-28 WO disclosed
EP-0705259-B1 PHENYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1998-02-25 EP 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-20110009622-A1 LONG-CHAIN FATTY ACYL ELONGASE INHIBITOR COMPRISING ARYLSULFONYL DERIVATIVE AS ACTIVE INGREDIENT ELOVL1, ELOVL6, ELOVL3 APEX1 2400/4885MCOLN3 3299/4885TSHR 3094/4885
US-20070021606-A1 Therapeutic compounds GRIN1, GRIN3A, GRM2 APEX1 2053/4885MCOLN3 2415/4885TSHR 685/4885

“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.