SCHEMBL8975878

SCHEMBL8975878

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

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 2/20 0.32
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 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
SCHEMBL8976360 0.77 KISS1R (0.31) ENPEP
SCHEMBL22828000 0.74
SCHEMBL56569 0.74
SCHEMBL16013532 0.74
Hydrochloric Acid SCHEMBL11420577 0.72
SCHEMBL8975857 0.71 HTT (0.38) ENPEPCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL8975926 0.70 CHRNB2 (0.32) ENPEPCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL29143693 0.70 CHRNB2 (0.45) ENPEPCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL29608537 0.69 TSHR (0.33) ENPEP
SCHEMBL9611232 0.68 GABRR1 (0.38) ENPEP

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