SCHEMBL11076550

SCHEMBL11076550

CCCCCC(=O)OCCCOc1ccc(Nc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.53
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
MAPT P10636 1/20 0.51
PTPN7 P35236 1/20 0.51
KMT2A Q03164 1/20 0.51
PTPN12 Q05209 1/20 0.51
PPARA Q07869 1/20 0.51
GAA P10253 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
EPHX2 P34913 2/20 0.51
LTA4H P09960 2/20 0.50
NAMPT P43490 1/20 0.49
PLA2G4B P0C869 1/20 0.49
DGKA P23743 1/20 0.47
ADAMTS5 Q9UNA0 1/20 0.47

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
SCHEMBL11504296 0.99 FAAH (0.55) FAAHMEN1ALDH1A1MAPTPTPN7
SCHEMBL11078448 0.96 FAAH (0.58) FAAHPPARAGAAL3MBTL1EPHX2
SCHEMBL11086042 0.96 FAAH (0.58) FAAHPPARAGAAL3MBTL1EPHX2
SCHEMBL11074875 0.89 PPARA (0.59) FAAHMEN1ALDH1A1MAPTPTPN7
SCHEMBL12060084 0.86 DGKA (0.61) FAAHLTA4HPLA2G4BDGKA
SCHEMBL16673027 0.83 LTA4H (0.61) MAPTGAAL3MBTL1LTA4H
SCHEMBL8962169 0.83 LTA4H (0.63) FAAHMEN1ALDH1A1MAPTPTPN7
SCHEMBL11505570 0.82 ALDH1A1 (0.58) MEN1ALDH1A1MAPTPTPN7KMT2A
SCHEMBL3228372 0.82 DGKA (0.62) FAAHLTA4HDGKA
SCHEMBL8962156 0.81 LTA4H (0.64) FAAHLTA4HNAMPTPLA2G4B

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
US-4141848-A ANTIOXIDANTS MOBIL OIL CORPORATION (US) 1979-02-27 US claimed
US-4457868-A Method for esterification MOBIL OIL CORPORATION (US) 1984-07-03 US disclosed
US-4141848-A ANTIOXIDANTS MOBIL OIL CORPORATION (US) 1979-02-27 US disclosed