SCHEMBL11410568

SCHEMBL11410568

CN(C)C(=O)COC(=O)CCc1ccccc1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.54
CYP4A11 Q02928 2/20 0.54
MAPT P10636 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
GAA P10253 2/20 0.47
MAPK1 P28482 1/20 0.47
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
NPC1 O15118 1/20 0.42
PKM P14618 1/20 0.42
RAB9A P51151 1/20 0.42
TYR P14679 1/20 0.40
CDYL Q9Y232 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HTR1A P08908 1/20 0.40
IAPP P10997 1/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL11409547 0.86 CYP4F2 (0.55) CYP4F2CYP4A11MAPTNPSR1GAA
SCHEMBL11416359 0.85 AKR1B1 (0.49) MAPTGAAMAPK1LMNAPKM
SCHEMBL11410892 0.84 CYP4F2 (0.68) CYP4F2CYP4A11MAPTGAANPC1
SCHEMBL1246063 0.83 CYP4F2 (0.76) CYP4F2CYP4A11MAPTGAALMNA
SCHEMBL29590131 0.82 IAPP (0.47) CYP4F2CYP4A11NPC1PKMRAB9A
SCHEMBL1958948 0.82 IAPP (0.47) CYP4F2CYP4A11NPC1PKMRAB9A
SCHEMBL11417156 0.82 CYP4F2 (0.53) CYP4F2CYP4A11MAPTLMNANPC1
SCHEMBL8969442 0.78 CYP4F2 (0.68) CYP4F2CYP4A11MAPTGAALMNA
SCHEMBL14360800 0.77 CYP4F2 (0.58) CYP4F2CYP4A11LMNANPC1PKM
SCHEMBL29852765 0.76 NPC1 (0.52) CYP4F2CYP4A11MAPTLMNANPC1

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
US-4214093-A PROTEOLYTIC ENZYME INHIBITORS TORII & CO., LTD. (JP) 1980-07-22 US disclosed