SCHEMBL1168898

SCHEMBL1168898

CCCCC(CO)NS(=O)(=O)c1ccc(Br)s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
MAPK1 P28482 1/20 0.44
HPGD P15428 1/20 0.42
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 4/20 0.41
HTT P42858 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HSP90AA1 P07900 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 3/20 0.40
THRB P10828 1/20 0.40
NLRP3 Q96P20 1/20 0.39
GALR3 O60755 1/20 0.39

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
SCHEMBL1169804 0.92 HPGD (0.43) SMN1; SMN2MAPK1HPGDCYP3A4CYP2D6
SCHEMBL1348037 0.86 HPGD (0.50) SMN1; SMN2MAPK1HPGDMEN1KMT2A
SCHEMBL1169666 0.84 KMT2A (0.54) SMN1; SMN2HPGDMEN1KMT2AHTT
SCHEMBL1169776 0.83 HPGD (0.41) SMN1; SMN2MAPK1HPGDCYP3A4CYP2D6
SCHEMBL1169468 0.81 SMN1; SMN2 (0.46) SMN1; SMN2MAPK1HPGDCYP3A4CYP2D6
SCHEMBL3180079 0.81 KMT2A (0.56) SMN1; SMN2HPGDMEN1KMT2AHTT
SCHEMBL1169603 0.80 PSEN1 (0.41) SMN1; SMN2MAPK1CYP3A4CYP2D6CYP2C9
SCHEMBL1169531 0.79 PSEN1 (0.40) SMN1; SMN2MAPK1CYP3A4CYP2D6CYP2C9
SCHEMBL1169565 0.79 PSEN1 (0.40) SMN1; SMN2MAPK1CYP3A4CYP2D6CYP2C9
SCHEMBL1169788 0.78 PSEN1 (0.40) SMN1; SMN2MAPK1CYP3A4CYP2D6CYP2C9

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-20110034513-A1 Heterocyclic Sulfonamide Inhibitors of Beta Amyloid Production WYETH LLC (US) 2011-02-10 US claimed
US-7691884-B2 Heterocyclic sulfonamide inhibitors of β amyloid production WYETH (US) 2010-04-06 US claimed
EP-1341779-B1 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH CORP (US) 2006-06-21 EP claimed
EP-1341779-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION Wyeth (US) 2003-09-10 EP claimed
US-6610734-B2 For therapy of Alzheimer's Disease and Down's syndrome WYETH 2003-08-26 US claimed
US-20020183361-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production ARQULE 2002-12-05 US claimed
WO-2002057252-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2002-07-25 WO claimed
EP-1341779-B1 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH CORP (US) 2006-06-21 EP disclosed
US-6610734-B2 For therapy of Alzheimer's Disease and Down's syndrome WYETH 2003-08-26 US 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-20110034513-A1 Heterocyclic Sulfonamide Inhibitors of Beta Amyloid Production APP, BACE1, PSEN1 SMN1; SMN2 691/4885MAPK1 1210/4885HPGD 864/4885
US-20020183361-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production APP, BACE1, PSEN1 SMN1; SMN2 478/4885MAPK1 882/4885HPGD 1143/4885

“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.