SCHEMBL2340928

SCHEMBL2340928

COc1cc(CN(C2CCC2)S(=O)(=O)c2ccc(Cl)cc2)ccc1OCCc1scnc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
LMNA P02545 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HSD17B10 Q99714 2/20 0.50
USP2 O75604 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
HIF1A Q16665 7/20 0.46
EP300 Q09472 1/20 0.46
PSEN1 P49768 6/20 0.45
PSEN2 P49810 6/20 0.45
APH1B Q8WW43 6/20 0.45
NCSTN Q92542 6/20 0.45
APH1A Q96BI3 6/20 0.45
PSENEN Q9NZ42 6/20 0.45
EPAS1 Q99814 6/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
ATM Q13315 2/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 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
SCHEMBL2336215 0.99 ALDH1A1 (0.51) ALDH1A1LMNASMN1; SMN2HSD17B10USP2
SCHEMBL2334245 0.98 ALDH1A1 (0.51) ALDH1A1LMNASMN1; SMN2HSD17B10USP2
SCHEMBL2331291 0.98 ALDH1A1 (0.51) ALDH1A1LMNASMN1; SMN2HSD17B10USP2
SCHEMBL2334385 0.94 ALDH1A1 (0.44) ALDH1A1LMNASMN1; SMN2HSD17B10USP2
SCHEMBL2341197 0.90 ALDH1A1 (0.59) ALDH1A1LMNASMN1; SMN2HSD17B10USP2
SCHEMBL2339078 0.87 HPGD (0.39) ALDH1A1LMNASMN1; SMN2HSD17B10USP2
SCHEMBL5509267 0.87 PSEN1 (0.65) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5522458 0.87 PSEN1 (0.65) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2335244 0.86 TP53 (0.44) ALDH1A1LMNASMN1; SMN2PSEN1PSEN2
SCHEMBL2339348 0.85 ALDH1A1 (0.43) ALDH1A1LMNASMN1; SMN2TSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2374792-A1 N-substituted benzene sulfonamides Elan Pharmaceuticals Inc. (US) 2011-10-12 EP disclosed
EP-2360142-A1 N-substituted benzene sulfonamides Elan Pharmaceuticals Inc. (US) 2011-08-24 EP disclosed