SCHEMBL8956500

SCHEMBL8956500

CNC(C)C(=O)NCCS

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.37
TSHR P16473 1/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 4/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
PTGS2 P35354 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PKM P14618 1/20 0.33
HDAC3 O15379 2/20 0.32
HDAC4 P56524 2/20 0.32
HDAC1 Q13547 2/20 0.32
HDAC7 Q8WUI4 2/20 0.32
HDAC2 Q92769 2/20 0.32
HDAC10 Q969S8 2/20 0.32
HDAC11 Q96DB2 2/20 0.32
HDAC8 Q9BY41 2/20 0.32
HDAC6 Q9UBN7 2/20 0.32

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
SCHEMBL8956601 0.81 USP2 (0.35) USP2TSHRMEN1KMT2AALDH1A1
SCHEMBL13687952 0.80 KMT2A (0.54) USP2TSHRMEN1KMT2AALDH1A1
SCHEMBL8749749 0.79
SCHEMBL8956526 0.79 USP2 (0.39) USP2TSHRMEN1KMT2AALDH1A1
SCHEMBL2019186 0.78 USP2 (0.37) USP2TSHRMEN1KMT2AALDH1A1
SCHEMBL2019183 0.78 USP2 (0.37) USP2TSHRMEN1KMT2AALDH1A1
SCHEMBL22183413 0.78 MEN1 (0.36) USP2TSHRMEN1KMT2AALDH1A1
SCHEMBL929185 0.77
SCHEMBL9593659 0.77
SCHEMBL8956871 0.76 CACNA1B (0.49) ALDH1A1MAPTLMNAANPEPDNPEP

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