SCHEMBL930069

SCHEMBL930069

CCC(S)C(=O)NC(C)(C)CS

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.34
ACE P12821 3/20 0.34
CPA1 P15085 3/20 0.34
ACE2 Q9BYF1 3/20 0.34
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PTGS2 P35354 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
USP2 O75604 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL930332 0.85 HDAC7 (0.35) ACEALDH1A1LMNAMAPTPTGS2
SCHEMBL12762555 0.80 ALDH1A1 (0.34) MMEACECPA1ACE2ALDH1A1
SCHEMBL931001 0.79 ACE (0.42) ACEALDH1A1LMNAMAPTPTGS2
SCHEMBL930121 0.73 ACE (0.35) ACE
SCHEMBL929827 0.72 PTGS1 (0.41) ALDH1A1MAPT
SCHEMBL928766 0.70
SCHEMBL13753136 0.70 ALDH1A1 (0.42) ALDH1A1
SCHEMBL23518169 0.69 MME (0.39) MMEACECPA1ACE2ALDH1A1
SCHEMBL12435313 0.69
SCHEMBL8909908 0.69

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
US-7875268-B2 The use of certain dimercaptoamides as reducing agents, 2-mercapto-N-(2-mercaptoethyl)acetamide, results in curling that is satisfactoryin terms of intensity and in terms of hold over time; less substantial degradation of the hair fiber compared with the reducing agents of the prior art; permanent waves L'OREAL S.A. (FR) 2011-01-25 US claimed
US-7875268-B2 The use of certain dimercaptoamides as reducing agents, 2-mercapto-N-(2-mercaptoethyl)acetamide, results in curling that is satisfactoryin terms of intensity and in terms of hold over time; less substantial degradation of the hair fiber compared with the reducing agents of the prior art; permanent waves L'OREAL S.A. (FR) 2011-01-25 US disclosed