SCHEMBL1168466

SCHEMBL1168466

O=C(O)CN(C1CCC(O)CC1)S(=O)(=O)c1ccc(Cl)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 1/20 0.41
PTGDR Q13258 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41
MMP8 P22894 1/20 0.41
MMP12 P39900 1/20 0.41
MMP13 P45452 1/20 0.41
ALDH1A1 P00352 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
TSHR P16473 2/20 0.39
LMNA P02545 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
NPC1 O15118 1/20 0.36
PSEN1 P49768 4/20 0.35
PSEN2 P49810 4/20 0.35
APH1B Q8WW43 4/20 0.35
NCSTN Q92542 4/20 0.35

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
SCHEMBL1583272 0.71 MAPT (0.47) MMP8MMP13ALDH1A1TSHRLMNA
SCHEMBL7359705 0.71 KEAP1 (0.56) MMP13ALDH1A1TSHRHTT
SCHEMBL16894083 0.70 NPC1 (0.43) TBXA2RPTGDRPTGDR2MMP8MMP12
SCHEMBL493215 0.68 MAPK1 (0.40) ALDH1A1L3MBTL1TSHRLMNAKMT2A
SCHEMBL264305 0.64 NPC1 (0.42) TBXA2RPTGDRPTGDR2MMP8MMP12
SCHEMBL3968836 0.64 NPSR1 (0.58) ALDH1A1L3MBTL1TSHRLMNAHTT
SCHEMBL2567557 0.63 MAPT (0.48) ALDH1A1L3MBTL1LMNATDP1GAA
SCHEMBL6984524 0.62 KMT2A (0.45) ALDH1A1TSHRGAAHPGDHTT
SCHEMBL1168417 0.62 PSEN1 (0.51) ALDH1A1L3MBTL1TSHRTDP1GAA
SCHEMBL4098966 0.62 NPC1 (0.38) TBXA2RPTGDRPTGDR2MMP8MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110034513-A1 Heterocyclic Sulfonamide Inhibitors of Beta Amyloid Production WYETH LLC (US) 2011-02-10 US disclosed
US-7842718-B2 Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH LLC (US) 2010-11-30 US disclosed
US-7691884-B2 Heterocyclic sulfonamide inhibitors of β amyloid production WYETH (US) 2010-04-06 US disclosed
US-20100022594-A1 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2010-01-28 US disclosed
EP-1341779-B1 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH CORP (US) 2006-06-21 EP disclosed
US-20050196813-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH (US) 2005-09-08 US disclosed
US-6878742-B2 Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH (US) 2005-04-12 US disclosed
US-20030229127-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH 2003-12-11 US disclosed
EP-1341779-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION Wyeth (US) 2003-09-10 EP disclosed
US-6610734-B2 For therapy of Alzheimer's Disease and Down's syndrome WYETH 2003-08-26 US disclosed
US-20020183361-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production ARQULE 2002-12-05 US disclosed
WO-2002057252-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2002-07-25 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 (4 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-20030229127-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production APP, BACE1, PSEN1 TBXA2R 2806/4885PTGDR 1209/4885PTGDR2 1723/4885
US-20100022594-A1 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION APP, BACE1, PSEN1 TBXA2R 1134/4885PTGDR 496/4885PTGDR2 879/4885
US-20110034513-A1 Heterocyclic Sulfonamide Inhibitors of Beta Amyloid Production APP, BACE1, PSEN1 TBXA2R 1134/4885PTGDR 496/4885PTGDR2 879/4885
US-20020183361-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production APP, BACE1, PSEN1 TBXA2R 2806/4885PTGDR 1209/4885PTGDR2 1723/4885

“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.