SCHEMBL8976008

SCHEMBL8976008

CN(C)C(CCS)C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA4 P43681 1/20 0.35
ANPEP P15144 1/20 0.34
ENPEP Q07075 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
FOLH1 Q04609 1/20 0.30
NOS2 P35228 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
SCHEMBL8976503 0.87 FOLH1 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4ENPEP
SCHEMBL8976585 0.84 FOLH1 (0.38) CHRNB2CHRNB4CHRNA3CHRNA4TDP1
SCHEMBL8976186 0.81 ANPEP (0.31) ANPEPENPEPCA1CA2
SCHEMBL13884916 0.79 HDAC7 (0.43) CHRNB2CHRNB4CHRNA3CHRNA4TDP1
SCHEMBL2127724 0.79 HDAC7 (0.43) CHRNB2CHRNB4CHRNA3CHRNA4TDP1
SCHEMBL11326837 0.79 GABRR1 (0.39) CHRNB2CHRNB4CHRNA3CHRNA4TDP1
SCHEMBL7280578 0.79 FOLH1 (0.40) ANPEPENPEPTDP1FOLH1
SCHEMBL8976269 0.78 ANPEP (0.32) ANPEPENPEPCA1CA2
SCHEMBL5886282 0.76 TDP1 (0.37) CHRNB2CHRNB4CHRNA3CHRNA4TDP1
SCHEMBL8183821 0.76 CPB2 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4TDP1

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