SCHEMBL8086516

SCHEMBL8086516

CCCCCCCCc1ccccc1CC(=O)O

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 9/20 0.56
CYSLTR1 Q9Y271 9/20 0.56
LIPG Q9Y5X9 1/20 0.56
ALDH1A1 P00352 1/20 0.56
BID P55957 3/20 0.55
MCL1 Q07820 3/20 0.55
BCL2L1 Q07817 2/20 0.55
BAK1 Q16611 2/20 0.55
KAT8 Q9H7Z6 2/20 0.55
PPARA Q07869 2/20 0.55
PPARG P37231 1/20 0.55
EP300 Q09472 1/20 0.55
KAT2A Q92830 1/20 0.55
KAT2B Q92831 1/20 0.55
KAT5 Q92993 1/20 0.55
SAE1 Q9UBE0 1/20 0.55

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
SCHEMBL10533245 1.00 CYSLTR2 (0.56) CYSLTR2CYSLTR1LIPGALDH1A1BID
SCHEMBL8080347 1.00 CYSLTR2 (0.56) CYSLTR2CYSLTR1LIPGALDH1A1BID
SCHEMBL9559902 1.00 CYSLTR2 (0.56) CYSLTR2CYSLTR1LIPGALDH1A1BID
SCHEMBL5509741 1.00 CYSLTR2 (0.56) CYSLTR2CYSLTR1LIPGALDH1A1BID
SCHEMBL8086397 1.00 CYSLTR2 (0.56) CYSLTR2CYSLTR1LIPGALDH1A1BID
SCHEMBL8072594 1.00 CYSLTR2 (0.56) CYSLTR2CYSLTR1LIPGALDH1A1BID
SCHEMBL7341368 0.98 ALDH1A1 (0.58) CYSLTR2CYSLTR1LIPGALDH1A1BID
Chloroform SCHEMBL17019954 0.95 CYSLTR2 (0.56) CYSLTR2CYSLTR1LIPGALDH1A1BID
SCHEMBL2461497 0.93 ALDH1A1 (0.56) CYSLTR2CYSLTR1ALDH1A1BIDMCL1
Bicarbonate SCHEMBL28742980 0.89 LIPG (0.63) CYSLTR2CYSLTR1LIPGBIDMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5952316-A FOR TREATING AUTOIMMUNE DISEASES, E.G., RHEUMATIOD ARTHRITIS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1999-09-14 US disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0627406-B1 2-AMINO-1,3-PROPANEDIOL COMPOUND AND IMMUNOSUPPRESSANT YOSHITOMI PHARMACEUTICAL (JP) 1998-10-28 EP disclosed
US-5719176-A 2-amino-1,3-propanediol compound and immunosuppressant YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1998-02-17 US disclosed
US-5604229-A 2-amino-1,3-propanediol compound and immunosuppressant YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-02-18 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed
EP-0627406-A1 2-AMINO-1,3-PROPANEDIOL COMPOUND AND IMMUNOSUPPRESSANT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-12-07 EP disclosed
CN-1025564-C Process for the preparation of phenyl epoxy hydroxy acid esters SMITHKLINE BECKMAN CORP (US) 1994-08-03 CN disclosed
CN-1008091-B Process for preparing leukotriene antagonists SMITHKLINE BECKMAN CORP (US) 1990-05-23 CN disclosed
CN-1040586-A Process for preparing leukotriene antagonists SMITHKLINE BECKMAN CORP (US) 1990-03-21 CN disclosed
CN-86102482-A Process for preparing leukotriene antagonists 1987-02-04 CN disclosed