SCHEMBL13299372

SCHEMBL13299372

CCCCOCC(O)CN(CCCC)CC(O)COCCCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.52
KDM4E B2RXH2 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
HTT P42858 1/20 0.50
MAPK1 P28482 1/20 0.50
LPAR5 Q9H1C0 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SPHK1 Q9NYA1 1/20 0.42
HSD17B10 Q99714 1/20 0.42
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 2/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
CASR P41180 1/20 0.37
POLB P06746 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL13609390 0.92 USP2 (0.52) USP2KDM4ETDP1HTTMAPK1
SCHEMBL25839458 0.92 USP2 (0.52) USP2KDM4ETDP1HTTMAPK1
SCHEMBL22104297 0.92 USP2 (0.56) USP2KDM4ETDP1HTTMAPK1
SCHEMBL22788472 0.90 USP2 (0.57) USP2KDM4ETDP1HTTMAPK1
SCHEMBL11878011 0.90 USP2 (0.54) USP2KDM4ETDP1HTTMAPK1
SCHEMBL26942254 0.89 USP2 (0.62) USP2KDM4ETDP1HTTMAPK1
SCHEMBL26942365 0.89 USP2 (0.62) USP2KDM4ETDP1HTTMAPK1
SCHEMBL26942252 0.89 USP2 (0.62) USP2KDM4ETDP1HTTMAPK1
SCHEMBL26942259 0.89 USP2 (0.62) USP2KDM4ETDP1HTTMAPK1
SCHEMBL26942166 0.89 USP2 (0.62) USP2KDM4ETDP1HTTMAPK1

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
WO-2010063612-A1 SILSESQUIOXANE PHOTOINITIATORS BASF SE (DE) 2010-06-10 WO disclosed