SCHEMBL4729598

SCHEMBL4729598

NCCCC(N)S(=O)(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.44
GSR P00390 1/20 0.38
BLM P54132 2/20 0.36
LMNA P02545 2/20 0.36
SLC6A6 P31641 1/20 0.36
CYP2C19 P33261 1/20 0.36
PMP22 Q01453 2/20 0.35
TP53 P04637 2/20 0.35
CPB2 Q96IY4 1/20 0.35
RNPEP Q9H4A4 1/20 0.32
GMNN O75496 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
THPO P40225 1/20 0.32
HBB P68871 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DPP4 P27487 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
GNAI3 P08754 1/20 0.31

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
SCHEMBL1628827 0.98 APP (0.42) APPGSRBLMLMNASLC6A6
SCHEMBL28869951 0.93 GSR (0.46) APPGSRBLMLMNASLC6A6
SCHEMBL28522824 0.84 TP53 (0.43) APPGSRTP53TSHR
SCHEMBL27959802 0.84
SCHEMBL27651668 0.80 TP53 (0.40) TP53
SCHEMBL27583723 0.78 TP53 (0.39) LMNATP53ALDH1A1TSHR
SCHEMBL4807123 0.78 TP53 (0.54) TP53MAPK1DPP7
SCHEMBL27583867 0.78 TP53 (0.39) LMNATP53ALDH1A1TSHR
SCHEMBL7028928 0.78 TP53 (0.43) APPGSRBLMLMNASLC6A6
SCHEMBL7108948 0.77 APP (0.46) APPGSRBLMLMNASLC6A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008052962-A1 METHOD FOR COLORING SUBSTRATES FROM POLYPROPYLENE BASF SE (DE) 2008-05-08 WO disclosed
US-4659753-A REINFORCEMENT FOR FILM-FORMING POLYMERS; BLOCKED POLYISOCYANATE AS CROSS LINKER; BAYER AKTIENGESELLSCHAFT (DE) 1987-04-21 US disclosed
US-4339566-A Water-dispersible, radiation-crosslinkable binding agents from urethane acrylates, a process for their production, and the use thereof in aqueous dispersions in color painting, color printing, and textile applications BAYER AKTIENGESELLSCHAFT (DE) 1982-07-13 US disclosed