SCHEMBL7933688

SCHEMBL7933688

O=C1CCC(=O)N1C(S)c1cccc(C(S)N2C(=O)CCC2=O)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
PKM P14618 1/20 0.39
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
PGK1 P00558 3/20 0.34
PGK2 P07205 3/20 0.34
RAF1 P04049 1/20 0.33
MAPK3 P27361 1/20 0.33
MAP3K8 P41279 1/20 0.33
MAP2K1 Q02750 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
CYP19A1 P11511 3/20 0.32
CYP11B1 P15538 3/20 0.32
CYP11B2 P19099 2/20 0.32
SLC1A2 P43004 1/20 0.31
BRD4 O60885 2/20 0.31

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
SCHEMBL7923888 0.80 ALDH1A1 (0.39) ALDH1A1PKMCHRM2CHRM4CHRM5
SCHEMBL7932066 0.76 ALDH1A1 (0.39) ALDH1A1PKMCHRM2CHRM4CHRM5
SCHEMBL7933681 0.76 ALDH1A1 (0.42) ALDH1A1PKMCHRM2CHRM4CHRM5
SCHEMBL7923865 0.71 ALDH1A1 (0.41) ALDH1A1PKMCHRM2CHRM4CHRM5
SCHEMBL7923891 0.71 L3MBTL1 (0.35) ALDH1A1PKMCHRM2CHRM4CHRM5
SCHEMBL7933823 0.69 ALDH1A1 (0.43) ALDH1A1PKMCHRM2CHRM4CHRM5
SCHEMBL40439 0.65 ALDH1A1 (0.53) ALDH1A1PKMCHRM2CHRM4CHRM5
SCHEMBL15581083 0.65 ALDH1A1 (0.47) ALDH1A1PKMCHRM2CHRM4CHRM5
SCHEMBL9632134 0.63 LMNA (0.53) ALDH1A1PKMCHRM2CHRM4CHRM5
SCHEMBL17106872 0.62 PGK1 (0.39) ALDH1A1PGK1PGK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0800551-B1 SULFUR-VULCANIZED RUBBER COMPOSITIONS COMPRISING SUBSTITUTED SUCCINIMIDE COMPOUNDS AKZO NOBEL NV (NL) 2001-06-13 EP disclosed
US-5844049-A Sulfur-vulcanized rubber compositions comprising substituted succinimide compounds AKZO NOBEL NV (NL) 1998-12-01 US disclosed
EP-0800551-A1 SULFUR-VULCANIZED RUBBER COMPOSITIONS COMPRISING SUBSTITUTED SUCCINIMIDE COMPOUNDS Akzo Nobel N.V. (NL) 1997-10-15 EP disclosed
WO-1996020246-A1 SULFUR-VULCANIZED RUBBER COMPOSITIONS COMPRISING SUBSTITUTED SUCCINIMIDE COMPOUNDS AKZO NOBEL N.V. (NL) 1996-07-04 WO disclosed