SCHEMBL9509870

SCHEMBL9509870

CCCCC(CC)C(=O)NS

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.68
CA1 P00915 5/20 0.68
MAPK1 P28482 2/20 0.57
USP2 O75604 1/20 0.50
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LMNA P02545 1/20 0.45
CA7 P43166 1/20 0.45
CA14 Q9ULX7 1/20 0.45
TSHR P16473 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL10437117 0.87 HDAC7 (0.52) CA2CA1MAPK1USP2CA7
SCHEMBL8460512 0.83 CA2 (0.73) CA2CA1MAPK1USP2MEN1
SCHEMBL7067275 0.82
SCHEMBL18935208 0.82 CA2 (0.66) CA2CA1MAPK1USP2MEN1
SCHEMBL8054453 0.81 CA2 (1.00) CA2CA1MAPK1USP2MEN1
SCHEMBL2106254 0.81 CA2 (0.70) CA2CA1MAPK1USP2MEN1
SCHEMBL5326388 0.81 CA2 (0.70) CA2CA1MAPK1USP2MEN1
SCHEMBL16389960 0.80 CA2 (0.63) CA2CA1MAPK1USP2MEN1
SCHEMBL16390492 0.80 CA2 (0.63) CA2CA1MAPK1USP2MEN1
SCHEMBL3911707 0.79 CA2 (0.68) CA2CA1MAPK1USP2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0432000-B1 REDUCING COMPOSITION FOR PERMANENT HAIRWAVING, COMPRISING AS REDUCING AGENT AN AMINO-MERCAPTOALKYLAMIDE OR ONE OF ITS SALTS, AND ITS USE IN A PROCESS FOR PERMANENT HAIRWAVING L'OREAL (FR) 1993-08-11 EP claimed
EP-0432000-A1 Reducing composition for permanent hairwaving, comprising as reducing agent an amino-mercaptoalkylamide or one of its salts, and its use in a process for permanent hairwaving L'OREAL (FR) 1991-06-12 EP claimed
EP-0432000-B1 REDUCING COMPOSITION FOR PERMANENT HAIRWAVING, COMPRISING AS REDUCING AGENT AN AMINO-MERCAPTOALKYLAMIDE OR ONE OF ITS SALTS, AND ITS USE IN A PROCESS FOR PERMANENT HAIRWAVING L'OREAL (FR) 1993-08-11 EP disclosed
EP-0432000-A1 Reducing composition for permanent hairwaving, comprising as reducing agent an amino-mercaptoalkylamide or one of its salts, and its use in a process for permanent hairwaving L'OREAL (FR) 1991-06-12 EP disclosed
EP-0354835-A1 N-(mercaptoalkyl)-omega-hydroxyalkyl amides and their use as reducing agents in a process for the permanent setting of hair L'OREAL (FR) 1990-02-14 EP disclosed