SCHEMBL8411534

SCHEMBL8411534

NC(=O)/C=C/C(=O)NCCS

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
MAPT P10636 2/20 0.35
HTT P42858 2/20 0.35
DDAH1 O94760 1/20 0.35
TAAR1 Q96RJ0 4/20 0.34
LMNA P02545 1/20 0.32
MCL1 Q07820 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC10 Q969S8 1/20 0.32
HDAC11 Q96DB2 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 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
SCHEMBL8411543 1.00 ALDH1A1 (0.35) ALDH1A1MAPTHTTDDAH1TAAR1
SCHEMBL9520204 1.00 ALDH1A1 (0.35) ALDH1A1MAPTHTTDDAH1TAAR1
SCHEMBL4879984 0.89 TAAR1 (0.39) ALDH1A1MAPTTAAR1HDAC3HDAC4
SCHEMBL8414190 0.88 ALDH1A1 (0.39) ALDH1A1MAPTHTTDDAH1TAAR1
SCHEMBL8414196 0.88 ALDH1A1 (0.39) ALDH1A1MAPTHTTDDAH1TAAR1
SCHEMBL8415006 0.84 HDAC3 (0.41) ALDH1A1MAPTTAAR1HDAC3HDAC4
SCHEMBL8415004 0.84 HDAC3 (0.41) ALDH1A1MAPTTAAR1HDAC3HDAC4
SCHEMBL8411518 0.81 PYGL (0.39) ALDH1A1MAPTHTTDDAH1LMNA
SCHEMBL8411513 0.81 PYGL (0.39) ALDH1A1MAPTHTTDDAH1LMNA
SCHEMBL8413411 0.80 ALDH1A1 (0.38) ALDH1A1MAPTTAAR1HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5985257-A HAIR PERMANENT L'OREAL (FR) 1999-11-16 US claimed
US-5935558-A FOR PERMANENT WAVING OF HAIR; IMPROVED CURLING, LOW ODOR L'OREAL, SA (FR) 1999-08-10 US claimed
EP-0653202-B1 Cosmetic composition containing an N-mercaptoalkyl alkanediamide or one of its cosmetically acceptable salts as a reducing agent OREAL (FR) 1998-03-04 EP claimed
EP-0653202-A1 Cosmetic composition containing an N-mercaptoalkyl alkanediamide or one of its cosmetically acceptable salts as a reducing agent L'OREAL (FR) 1995-05-17 EP claimed
US-5985257-A HAIR PERMANENT L'OREAL (FR) 1999-11-16 US disclosed
US-5935558-A FOR PERMANENT WAVING OF HAIR; IMPROVED CURLING, LOW ODOR L'OREAL, SA (FR) 1999-08-10 US disclosed
US-5843416-A Cosmetic composition containing an n-mercaptoalkylalkanediamide or one of its cosmetically acceptable salts as reducing agent L'OREAL (FR) 1998-12-01 US disclosed
EP-0653202-B1 Cosmetic composition containing an N-mercaptoalkyl alkanediamide or one of its cosmetically acceptable salts as a reducing agent OREAL (FR) 1998-03-04 EP disclosed
US-5700454-A FOR PERMANENT WAVING OF HAIR WITH IMPROVED CURLING EFFICIENCY L'OREAL (FR) 1997-12-23 US disclosed
EP-0653202-A1 Cosmetic composition containing an N-mercaptoalkyl alkanediamide or one of its cosmetically acceptable salts as a reducing agent L'OREAL (FR) 1995-05-17 EP disclosed