SCHEMBL4769827

SCHEMBL4769827

CC(NC(=O)O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 2/20 0.48
MMP8 P22894 2/20 0.48
SLC1A3 P43003 2/20 0.47
SLC1A2 P43004 2/20 0.47
SLC1A1 P43005 2/20 0.47
MEN1 O00255 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 1/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
ALDH1A1 P00352 1/20 0.47
PSMB5 P28074 1/20 0.47
LMNA P02545 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ATM Q13315 1/20 0.46
CTSK P43235 2/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL11124090 0.88 LMNA (0.51) MMP9MMP8SLC1A3SLC1A2SLC1A1
SCHEMBL25295191 0.85 KMT2A (0.43) MEN1KMT2AALDH1A1LMNAATM
SCHEMBL4776106 0.85 CYP19A1 (0.42) ALDH1A1LMNAL3MBTL1TSHR
SCHEMBL15716272 0.81 PSMB5 (0.47) MMP9MMP8SLC1A3SLC1A2SLC1A1
SCHEMBL20551984 0.81 PSMB5 (0.47) MMP9MMP8SLC1A3SLC1A2SLC1A1
SCHEMBL4973401 0.80 MMP9 (0.44) MMP9MMP8SLC1A3SLC1A2SLC1A1
SCHEMBL23888735 0.79 MMP9 (0.44) MMP9MMP8SLC1A3SLC1A2SLC1A1
SCHEMBL11505839 0.79 SLC1A3 (0.41) MMP9MMP8SLC1A3SLC1A2SLC1A1
SCHEMBL12493209 0.79 MMP9 (0.43) MMP9MMP8SLC1A3SLC1A2SLC1A1
SCHEMBL19056974 0.79 MMP9 (0.49) MMP9MMP8SLC1A3SLC1A2SLC1A1

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
EP-1513524-A4 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES CO (US) 2008-09-03 EP disclosed
EP-1513524-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2005-03-16 EP disclosed
WO-2003103584-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-12-18 WO disclosed