SCHEMBL6209739

SCHEMBL6209739

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

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 1/20 0.42
ANPEP P15144 1/20 0.34
ENPEP Q07075 1/20 0.34
MMP3 P08254 7/20 0.33
MMP1 P03956 7/20 0.33
MMP9 P14780 6/20 0.33
ACE P12821 1/20 0.33
FOLH1 Q04609 1/20 0.33
CPB2 Q96IY4 1/20 0.31
HDAC7 Q8WUI4 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
HDAC9 Q9UKV0 1/20 0.30
HDAC5 Q9UQL6 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
SCHEMBL2872488 0.83 BMP1 (0.45) BMP1ANPEPENPEPMMP3MMP1
SCHEMBL2873906 0.82
SCHEMBL2874729 0.79 BMP1 (0.42) BMP1ANPEPENPEPMMP3MMP1
SCHEMBL2868527 0.78 FOLH1 (0.44) BMP1MMP3MMP1MMP9FOLH1
SCHEMBL9814833 0.78 BMP1 (0.45) BMP1ANPEPENPEPMMP3MMP1
SCHEMBL15499529 0.74 BMP1 (0.41) BMP1ANPEPENPEPMMP3MMP1
SCHEMBL2868532 0.73 FOLH1 (0.41) BMP1ANPEPENPEPMMP3MMP1
SCHEMBL2871456 0.68 CA2 (0.44) BMP1MMP3MMP1MMP9FOLH1
SCHEMBL5471418 0.67 MAPT (0.39) BMP1ANPEPENPEPMMP3MMP1
SCHEMBL7359742 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1570835-A1 Composition for the permanent deformatioh of the hair comprising at least one carboxydithiol L'OREAL (FR) 2005-09-07 EP claimed