SCHEMBL8975875

SCHEMBL8975875

CCCNC(CCS)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.34
CA2 P00918 1/20 0.34
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP9 P14780 1/20 0.31
CA12 O43570 1/20 0.31
CA9 Q16790 1/20 0.31
ANPEP P15144 1/20 0.31
ENPEP Q07075 1/20 0.31
CTSD P07339 1/20 0.30
DPP7 Q9UHL4 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
SCHEMBL8976621 0.89 CA1 (0.40) CA1CA2MMP2DPP7
SCHEMBL8975813 0.84 MMP3 (0.33) CA1CA2MMP3MMP9ANPEP
SCHEMBL5867413 0.82 GGT1 (0.41) CA2MMP1MMP2MMP3MMP9
SCHEMBL474687 0.82 GGT1 (0.41) CA2MMP1MMP2MMP3MMP9
SCHEMBL474688 0.82 GGT1 (0.41) CA2MMP1MMP2MMP3MMP9
Hydrogen Sulfide SCHEMBL28215383 0.81 CA1 (0.34) CA1CA2MMP1MMP2MMP3
SCHEMBL21206997 0.79 CA1 (0.39) CA1CA2MMP1MMP2MMP3
SCHEMBL20885051 0.79 ALDH1A1 (0.37) CA1CA2MMP1MMP2MMP3
SCHEMBL2242492 0.79 FOLH1 (0.41) CA1CA12CA9
SCHEMBL21206958 0.78 TGFBR1 (0.36) CA1CA2MMP1MMP2MMP3

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-0514282-B1 Alkylamino mercaptoalkylamides or salts thereof acceptable for cosmetic use, their use as a reducing agent and a process for the permanent deformation of hair OREAL (FR) 1996-04-10 EP claimed