SCHEMBL8644751

SCHEMBL8644751

C=C(C)COCCOC(=O)C(=O)OCc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.50
FFAR1 O14842 1/20 0.49
FFAR4 Q5NUL3 1/20 0.49
ALOX5 P09917 2/20 0.48
PTGS1 P23219 1/20 0.48
PTGS2 P35354 1/20 0.48
EGFR P00533 2/20 0.47
LTA4H P09960 2/20 0.47
EPHX2 P34913 1/20 0.47
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
HTT P42858 1/20 0.46
NR4A1 P22736 1/20 0.46
NR4A2 P43354 1/20 0.46
NR4A3 Q92570 1/20 0.46
LTB4R Q15722 1/20 0.44
LTB4R2 Q9NPC1 1/20 0.44
NR1H4 Q96RI1 1/20 0.44
LAP3 P28838 1/20 0.44

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
SCHEMBL8644756 0.87 MAOB (0.55) MAOBFFAR1FFAR4ALOX5PTGS1
SCHEMBL8642346 0.85 ALDH1A1 (0.44) FFAR1ALOX5ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL1228881 0.81 PTGS1 (0.56) MAOBFFAR1FFAR4ALOX5PTGS1
SCHEMBL8333346 0.81 NR4A1 (0.66) MAOBFFAR1FFAR4ALOX5PTGS1
SCHEMBL9111006 0.81 ALDH1A1 (0.40) FFAR1ALOX5ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL8644717 0.78 L3MBTL1 (0.45) ALDH1A1SMN1; SMN2L3MBTL1HTTRAB9A
SCHEMBL29332969 0.77 HTT (0.54) MAOBFFAR1FFAR4ALOX5PTGS1
SCHEMBL1229367 0.77 PTGS1 (0.61) MAOBALOX5PTGS1PTGS2EGFR
SCHEMBL18106792 0.77 POLB (0.53) MAOBFFAR1FFAR4ALDH1A1SMN1; SMN2
SCHEMBL8333349 0.75 NR4A1 (0.62) MAOBFFAR1FFAR4ALOX5PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665960-B1 IMAGING MEDIUM AND PROCESS POLAROID CORP (US) 1998-08-19 EP disclosed
US-5578424-A EXPOSING A MIXTURE OF AN ACID PRECURSOR AND A DYE TO ACTINIC RADIATION TO DECOMPOSE PRECURSOR POLAROID CORPORATION (US) 1996-11-26 US disclosed
EP-0665961-B1 IMAGING MEDIUM AND PROCESS POLAROID CORP (US) 1996-10-02 EP disclosed
US-5534388-A SUPERACID PRECURSOR IS EXPOSED TO ACTINIC RADIATION TO GENERATE SUPERACID; COLORIMETRIC ANALYSIS POLAROID CORPORATION (US) 1996-07-09 US disclosed
US-5453345-A Imaging medium POLAROID CORPORATION (US) 1995-09-26 US disclosed
US-5445917-A Superacid precursor to catalyze thermal decomposition of secondary acid generator, such as squaric acid and oxalic acid derivatives; effecting color change in imaging process POLAROID CORPORATION (US) 1995-08-29 US disclosed
EP-0665961-A1 IMAGING MEDIUM AND PROCESS. POLAROID CORP (US) 1995-08-09 EP disclosed
US-5395736-A Exposing superoxide precursor to actinic radiation, generating superacid, mixing with oxalic acid diester, heating POLAROID CORPORATION (US) 1995-03-07 US disclosed
WO-1994010607-A1 IMAGING MEDIUM AND PROCESS POLAROID CORPORATION (US) 1994-05-11 WO disclosed