SCHEMBL8956908

SCHEMBL8956908

CCN(C)CC(=O)NCCS

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
RAB9A P51151 1/20 0.37
DNM1 Q05193 2/20 0.37
HDAC1 Q13547 9/20 0.36
HDAC10 Q969S8 9/20 0.36
HDAC6 Q9UBN7 9/20 0.36
HDAC8 Q9BY41 8/20 0.36
HDAC3 O15379 7/20 0.36
HDAC4 P56524 7/20 0.36
HDAC7 Q8WUI4 7/20 0.36
HDAC2 Q92769 7/20 0.36
HDAC11 Q96DB2 7/20 0.36
HDAC9 Q9UKV0 7/20 0.36
HDAC5 Q9UQL6 7/20 0.36
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 1/20 0.31
CASP2 P42575 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
SCHEMBL14068827 0.84 MEN1 (0.37) MEN1KMT2ARAB9ADNM1HDAC1
SCHEMBL8956453 0.83 HDAC1 (0.40) MEN1KMT2ARAB9ADNM1HDAC1
SCHEMBL4578116 0.82 MEN1 (0.37) MEN1KMT2ARAB9ADNM1SMN1; SMN2
SCHEMBL8956368 0.82 ALDH1A1 (0.40) MEN1KMT2ARAB9ADNM1HDAC1
SCHEMBL13614831 0.82 CNR1 (0.40) MEN1KMT2ADNM1
SCHEMBL5034969 0.79 MCL1 (0.41) MEN1KMT2ARAB9ALMNA
SCHEMBL24393605 0.77 DNM1 (0.35) MEN1KMT2ADNM1HDAC1HDAC10
SCHEMBL26838432 0.74 MCL1 (0.48) MEN1KMT2ARAB9ADNM1SMN1; SMN2
SCHEMBL582964 0.73 ALDH1A1 (0.31) MEN1KMT2A
SCHEMBL888282 0.73

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 4 patents. 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
US-5583257-A REDUCING AGENTS FOR PERMANENT HAIR; ODORLESS L'OREAL (FR) 1996-12-10 US disclosed
US-5449805-A Permanent waves for hair L'OREAL (FR) 1995-09-12 US disclosed
US-5334377-A Reduction of the disulfide bond of keratin; the oxidation L'OREAL (FR) 1994-08-02 US disclosed