SCHEMBL5504401

SCHEMBL5504401

CCCCCCN(C(C)CC)S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.50
PSEN1 P49768 10/20 0.46
PSEN2 P49810 10/20 0.46
APH1B Q8WW43 10/20 0.46
NCSTN Q92542 10/20 0.46
APH1A Q96BI3 10/20 0.46
PSENEN Q9NZ42 10/20 0.46
SERPINE1 P05121 1/20 0.41
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA9 Q16790 2/20 0.41
CA2 P00918 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41

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
SCHEMBL2332910 0.82 ADAMTS5 (0.51) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL2332915 0.82 ADAMTS5 (0.51) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL5512141 0.80 TDP1 (0.61) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL8911648 0.79 CNR2 (0.67) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL2336639 0.78 CNR2 (0.46) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL2336636 0.78 CNR2 (0.46) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL2335090 0.76 MEN1 (0.44) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL2338732 0.76 CA1 (0.50) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL27994291 0.75 CNR2 (0.45) CNR2SERPINE1CA12CA1CA9
SCHEMBL2336036 0.75 PSEN1 (0.58) CNR2PSEN1PSEN2APH1BNCSTN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1549306-A4 SUBSTITUTED PHENYLSULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH CORP (US) 2007-06-06 EP claimed
EP-1549306-A1 SUBSTITUTED PHENYLSULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION Wyeth (US) 2005-07-06 EP claimed
WO-2003103660-A1 SUBSTITUTED PHENYLSULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2003-12-18 WO claimed