SCHEMBL7412653

SCHEMBL7412653

CC(C)(C)OC(=O)C(CCOCc1ccccc1)CC1(C(=O)O)CCCC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.40
PPARA Q07869 2/20 0.40
MME P08473 7/20 0.38
CYP2C19 P33261 1/20 0.37
PPARG P37231 1/20 0.37
LTA4H P09960 1/20 0.37
CTSS P25774 1/20 0.36
SYK P43405 1/20 0.36
MMP1 P03956 3/20 0.36
MMP3 P08254 3/20 0.36
MMP9 P14780 2/20 0.35
MMP8 P22894 2/20 0.35

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
SCHEMBL9469250 0.94 L3MBTL1 (0.46) L3MBTL1PPARAMMEPPARGLTA4H
SCHEMBL7321839 0.86 MME (0.45) MMECTSSMMP1MMP3MMP9
SCHEMBL7412656 0.84 L3MBTL1 (0.39) L3MBTL1PPARACYP2C19PPARGLTA4H
SCHEMBL4992578 0.83 SLC15A1 (0.43) L3MBTL1PPARAMMECYP2C19SYK
SCHEMBL6807982 0.83 MME (0.45) MMESYK
SCHEMBL9363228 0.83 MME (0.33) MMECYP2C19
SCHEMBL7408700 0.82 L3MBTL1 (0.37) L3MBTL1PPARACYP2C19PPARGLTA4H
SCHEMBL7364029 0.81 SYK (0.51) MMECTSSSYK
SCHEMBL7450142 0.80 MME (0.47) MMESYK
SCHEMBL5702723 0.80 MME (0.41) MMECYP2C19

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-5854275-A Cyclic imide derivatives PFIZER INC. (US) 1998-12-29 US disclosed