SCHEMBL8976503

SCHEMBL8976503

CN(C)C(CCCS)C(N)=O

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.34
CHRNB2 P17787 2/20 0.33
CHRNB4 P30926 2/20 0.33
CHRNA4 P43681 2/20 0.33
ENPEP Q07075 1/20 0.33
CHRNA3 P32297 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
NOS2 P35228 2/20 0.32
NOS3 P29474 1/20 0.30
NOS1 P29475 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
SCHEMBL8976585 0.92 FOLH1 (0.38) FOLH1CHRNB2CHRNB4CHRNA4CHRNA3
SCHEMBL8976008 0.87 CHRNB2 (0.35) FOLH1CHRNB2CHRNB4CHRNA4ENPEP
SCHEMBL4595724 0.81 CA2 (0.52) CHRNB2CHRNB4CHRNA4CHRNA3CA1
SCHEMBL4594560 0.81 CA2 (0.52) CHRNB2CHRNB4CHRNA4CHRNA3CA1
SCHEMBL4594802 0.81 CA2 (0.52) CHRNB2CHRNB4CHRNA4CHRNA3CA1
SCHEMBL8183821 0.81 CPB2 (0.36) CHRNB2CHRNB4CHRNA4CHRNA3CA1
SCHEMBL8183812 0.81 CPB2 (0.36) CHRNB2CHRNB4CHRNA4CHRNA3CA1
SCHEMBL8976220 0.80 CA1 (0.34) FOLH1ENPEPCA1CA2
SCHEMBL20411610 0.79 GSR (0.42) FOLH1CHRNB2CHRNB4CHRNA4CHRNA3
SCHEMBL2280438 0.79 GSR (0.42) FOLH1CHRNB2CHRNB4CHRNA4CHRNA3

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