SCHEMBL930303

SCHEMBL930303

CC(C)(CS)NC(=O)CCS

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.45
L3MBTL1 Q9Y468 3/20 0.33
POLB P06746 2/20 0.33
GRK2 P25098 2/20 0.33
APAF1 O14727 1/20 0.33
DNMT1 P26358 1/20 0.33
PTPN7 P35236 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33
PPP1CA P62136 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
PTPN22 Q9Y2R2 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL929281 0.87 ALDH1A1 (0.52) ALDH1A1L3MBTL1POLBGRK2APAF1
SCHEMBL931027 0.85 ALDH1A1 (0.55) ALDH1A1L3MBTL1POLBGRK2APAF1
SCHEMBL13920753 0.84 ALDH1A1 (0.53) ALDH1A1L3MBTL1POLBGRK2APAF1
SCHEMBL23967240 0.84 ALDH1A1 (0.44) ALDH1A1L3MBTL1POLBGRK2APAF1
SCHEMBL14270532 0.83 ALDH1A1 (0.42) ALDH1A1L3MBTL1POLBGRK2APAF1
SCHEMBL3897665 0.81 SMN1; SMN2 (0.44) ALDH1A1POLBLMNATSHRHPGD
SCHEMBL929301 0.81 ALDH1A1 (0.39) ALDH1A1L3MBTL1TSHRHPGDKDM4E
SCHEMBL18415525 0.81 ALDH1A1 (0.50) ALDH1A1L3MBTL1POLBGRK2APAF1
SCHEMBL13753136 0.79 ALDH1A1 (0.42) ALDH1A1L3MBTL1MEN1KMT2AHPGD
SCHEMBL13751136 0.78 POLB (0.42) ALDH1A1L3MBTL1POLBGRK2APAF1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7875268-B2 The use of certain dimercaptoamides as reducing agents, 2-mercapto-N-(2-mercaptoethyl)acetamide, results in curling that is satisfactoryin terms of intensity and in terms of hold over time; less substantial degradation of the hair fiber compared with the reducing agents of the prior art; permanent waves L'OREAL S.A. (FR) 2011-01-25 US claimed
EP-1584615-B1 Use of dimercaptoamides for permanently deforming of keratinic fibres OREAL (FR) 2008-05-28 EP claimed
US-20060013784-A1 Novel dimercaptoamides, compositions comprising them as reducing agents, and processes for permanently reshaping keratin fibers therewith L'OREAL S.A. (FR) 2006-01-19 US claimed
EP-1584615-A1 Use of dimercaptoamides for permanently deforming of keratinic fibres L'OREAL (FR) 2005-10-12 EP claimed
US-7875268-B2 The use of certain dimercaptoamides as reducing agents, 2-mercapto-N-(2-mercaptoethyl)acetamide, results in curling that is satisfactoryin terms of intensity and in terms of hold over time; less substantial degradation of the hair fiber compared with the reducing agents of the prior art; permanent waves L'OREAL S.A. (FR) 2011-01-25 US disclosed
EP-1584615-B1 Use of dimercaptoamides for permanently deforming of keratinic fibres OREAL (FR) 2008-05-28 EP disclosed
US-20060013784-A1 Novel dimercaptoamides, compositions comprising them as reducing agents, and processes for permanently reshaping keratin fibers therewith L'OREAL S.A. (FR) 2006-01-19 US disclosed
EP-1584615-A1 Use of dimercaptoamides for permanently deforming of keratinic fibres L'OREAL (FR) 2005-10-12 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060013784-A1 Novel dimercaptoamides, compositions comprising them as reducing agents, and processes for permanently reshaping keratin fibers therewith KRT18, CKAP4, S100A4 ALDH1A1 3512/4885L3MBTL1 4554/4885POLB 2196/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.