SCHEMBL8412475

SCHEMBL8412475

CCNC(=O)/C=C/C(=O)NCCS

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
SLC6A19 Q695T7 1/20 0.37
ZDHHC20 Q5W0Z9 3/20 0.35
ZDHHC2 Q9UIJ5 3/20 0.35
TAAR1 Q96RJ0 4/20 0.34
EGFR P00533 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL8412480 1.00 ALDH1A1 (0.41) ALDH1A1SLC6A19ZDHHC20ZDHHC2TAAR1
SCHEMBL4879984 0.89 TAAR1 (0.39) ALDH1A1TAAR1MMP1MMP2MMP9
SCHEMBL2535335 0.83 SLC6A19 (0.44) ALDH1A1SLC6A19ZDHHC20ZDHHC2LMNA
SCHEMBL1395636 0.83 SLC6A19 (0.44) ALDH1A1SLC6A19ZDHHC20ZDHHC2LMNA
SCHEMBL1395660 0.83 SLC6A19 (0.44) ALDH1A1SLC6A19ZDHHC20ZDHHC2LMNA
SCHEMBL8411356 0.83 ALDH1A1 (0.37) ALDH1A1ZDHHC20ZDHHC2TAAR1
SCHEMBL16257482 0.83 ALDH1A1 (0.37) ALDH1A1ZDHHC20ZDHHC2TAAR1
SCHEMBL8411353 0.83 ALDH1A1 (0.37) ALDH1A1ZDHHC20ZDHHC2TAAR1
SCHEMBL8413411 0.80 ALDH1A1 (0.38) ALDH1A1TAAR1MAPT
SCHEMBL3064686 0.80 ALDH1A1 (0.52) ALDH1A1TAAR1LMNA

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