SCHEMBL9506124

SCHEMBL9506124

NCCCCCC(=O)NCCSSCCNC(=O)CCCCCN

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 2/20 0.51
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
PLG P00747 1/20 0.43
LMNA P02545 1/20 0.43
THRB P10828 1/20 0.43
ALOX15 P16050 1/20 0.43
SLC6A2 P23975 1/20 0.43
RECQL P46063 1/20 0.43
SLC6A3 Q01959 1/20 0.43
KMT2A Q03164 1/20 0.43
PAOX Q6QHF9 4/20 0.42
FAAH O00519 3/20 0.42
CYP3A4 P08684 1/20 0.41
KDM4A O75164 1/20 0.41
HIF1A Q16665 1/20 0.41
TET2 Q6N021 1/20 0.41
DOHH Q9BU89 1/20 0.41
MMP2 P08253 1/20 0.41
LPAR1 Q92633 1/20 0.40

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
SCHEMBL9505929 0.92 CA1 (0.43) SLC6A5LMNATHRBKMT2APAOX
SCHEMBL16015493 0.90 SLC6A5 (0.50) SLC6A5MEN1ALDH1A1PLGLMNA
SCHEMBL17039863 0.86 SLC6A5 (0.59) SLC6A5MEN1ALDH1A1PLGLMNA
SCHEMBL13302376 0.85 ALDH1A1 (0.47) SLC6A5ALDH1A1FAAHLPAR1DNM1
SCHEMBL7208464 0.84 SLC6A5 (0.67) SLC6A5MEN1ALDH1A1PLGLMNA
SCHEMBL7215946 0.84 SLC6A5 (0.67) SLC6A5MEN1ALDH1A1PLGLMNA
SCHEMBL7203302 0.84 SLC6A5 (0.67) SLC6A5MEN1ALDH1A1PLGLMNA
SCHEMBL7209833 0.84 SLC6A5 (0.67) SLC6A5MEN1ALDH1A1PLGLMNA
SCHEMBL22289072 0.84 SLC6A5 (0.57) SLC6A5MEN1ALDH1A1PLGLMNA
SCHEMBL7215984 0.84 SLC6A5 (0.67) SLC6A5MEN1ALDH1A1PLGLMNA

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 1 patent. 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