SCHEMBL8956497

SCHEMBL8956497

CCC(NC)C(=O)NCCS

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.43
TSHR P16473 1/20 0.43
CACNA1B Q00975 2/20 0.33
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
DPP7 Q9UHL4 1/20 0.31
MME P08473 1/20 0.31
ACE P12821 1/20 0.31
CPA1 P15085 1/20 0.31
ACE2 Q9BYF1 1/20 0.31
SIRT6 Q8N6T7 1/20 0.30
SIRT1 Q96EB6 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC4 P56524 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC7 Q8WUI4 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
SCHEMBL8956871 0.81 CACNA1B (0.49) CACNA1BCTSSCTSKALDH1A1MAPT
SCHEMBL20414868 0.78 ECE1 (0.47) USP2TSHRMMEACE
SCHEMBL8975939 0.76 USP2 (0.39) USP2TSHRCTSSCTSKMME
SCHEMBL8956500 0.75 USP2 (0.37) USP2TSHRACEMEN1ALDH1A1
SCHEMBL929317 0.75 USP2 (0.46) USP2TSHRDPP7MMEACE
SCHEMBL27507044 0.73 DPP7 (0.47) USP2TSHRDPP7
SCHEMBL19245403 0.73
SCHEMBL15834073 0.73
SCHEMBL10296137 0.73
SCHEMBL8956611 0.73 USP2 (0.36) USP2TSHR

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