SCHEMBL3449751

SCHEMBL3449751

CC(C)OC(=O)OCCN1C(=O)C=CC1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 6/20 0.47
ALDH1A1 P00352 4/20 0.42
BLM P54132 2/20 0.42
HPGD P15428 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
WRN Q14191 1/20 0.42
HIF1A Q16665 1/20 0.42
FLT3 P36888 3/20 0.41
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
FAAH O00519 3/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
GMNN O75496 1/20 0.39
THPO P40225 1/20 0.39
PMP22 Q01453 1/20 0.39
HSP90AA1 P07900 1/20 0.38
TLR9 Q9NR96 1/20 0.38

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
SCHEMBL861954 0.84 MGLL (0.59) MGLLALDH1A1BLMHPGDCYP1A2
SCHEMBL14480521 0.79 MGLL (0.50) MGLLALDH1A1BLMHPGDCYP1A2
SCHEMBL3448487 0.79 GSK3A (0.56) MGLLALDH1A1BLMHPGDCYP1A2
SCHEMBL8887339 0.79 MGLL (0.53) MGLLALDH1A1BLMHPGDCYP1A2
SCHEMBL14890967 0.77 MGLL (0.68) MGLLALDH1A1BLMHPGDCYP1A2
SCHEMBL3173590 0.77 MGLL (0.55) MGLLALDH1A1BLMHPGDCYP1A2
SCHEMBL22002013 0.74 MGLL (0.57) MGLLALDH1A1BLMHPGDCYP1A2
SCHEMBL31275366 0.74 MGLL (0.69) MGLLALDH1A1BLMHPGDCYP1A2
SCHEMBL17565659 0.74 MGLL (0.44) MGLLALDH1A1BLMHPGDCYP1A2
SCHEMBL8888253 0.74 MGLL (0.44) MGLLALDH1A1BLMHPGDCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1952184-B1 PHOTOCHROMIC MULTIFOCAL OPTICAL ARTICLE TRANSITIONS OPTICAL INC (US) 2021-08-11 EP disclosed
US-7811480-B2 Photochromic optical article TRANSITIONS OPTICAL, INC. (US) 2010-10-12 US disclosed
EP-1952184-A2 PHOTOCHROMIC MULTIFOCAL OPTICAL ARTICLE TRANSITIONS OPTICAL, INC. (US) 2008-08-06 EP disclosed
US-7258437-B2 Photochromic multifocal optical article TRANSITIONS OPTICAL, INC. (US) 2007-08-21 US disclosed
WO-2007030352-A2 PHOTOCHROMIC MULTIFOCAL OPTICAL ARTICLE TRANSITIONS OPTICAL, INC. (US) 2007-03-15 WO disclosed
US-20070052922-A1 Photochromic multifocal optical article TRANSITIONS OPTICAL LIMITED (IE) 2007-03-08 US disclosed
WO-2005093006-A1 PHOTOCHROMIC OPTICAL ARTICLE TRANSITIONS OPTICAL, INC. (US) 2005-10-06 WO disclosed
US-20050196696-A1 Photochromic optical article TRANSITIONS OPTICAL LIMITED (IE) 2005-09-08 US disclosed
WO-2004014970-A1 PHOTOCURABLE COMPOSITION CONTAINING MALEIDE DERIVATIVES 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-02-19 WO disclosed
US-20040029044-A1 Photocurable composition 3M INNOVATIVE PROPERTIES COMPANY 2004-02-12 US disclosed