SCHEMBL8975745

SCHEMBL8975745

CCN(CC)C(CCCCCS)C(N)=O

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.36
CPB2 Q96IY4 2/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
GRIK1 P39086 1/20 0.31
GRIK2 Q13002 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
SCHEMBL8976220 0.93 CA1 (0.34) FOLH1CA1CA2
SCHEMBL28499660 0.85 GRIK1 (0.43) CA1CA2GRIK1GRIK2
SCHEMBL31682514 0.85 GRIK1 (0.43) CA1CA2GRIK1GRIK2
SCHEMBL8976269 0.85 ANPEP (0.32) CA1CA2
SCHEMBL4312638 0.83 CA1 (0.44) CA1CA2GRIK1GRIK2
SCHEMBL8976585 0.81 FOLH1 (0.38) FOLH1CPB2CA1CA2
SCHEMBL8976503 0.73 FOLH1 (0.34) FOLH1CA1CA2
SCHEMBL18289808 0.72 KDM4E (0.44) FOLH1CA1CA2
SCHEMBL19286939 0.72 CA1 (0.37) CA1CA2
SCHEMBL2244862 0.72 GABRP (0.43) GRIK1GRIK2

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