SCHEMBL6818282

SCHEMBL6818282

CCCCCCCCCCOCC(O)COS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2C Q5R387 1/20 0.53
LPAR5 Q9H1C0 1/20 0.47
USP2 O75604 1/20 0.47
HTT P42858 2/20 0.46
MCHR1 Q99705 1/20 0.40
PLA2G4B P0C869 1/20 0.40
SPHK1 Q9NYA1 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
ALOX12 P18054 1/20 0.36
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36

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
SCHEMBL6814001 1.00 PLA2G2C (0.53) PLA2G2CLPAR5USP2HTTMCHR1
SCHEMBL25956397 1.00 PLA2G2C (0.53) PLA2G2CLPAR5USP2HTTMCHR1
SCHEMBL25967510 1.00 PLA2G2C (0.53) PLA2G2CLPAR5USP2HTTMCHR1
SCHEMBL9575937 1.00 PLA2G2C (0.53) PLA2G2CLPAR5USP2HTTMCHR1
SCHEMBL9575934 1.00 PLA2G2C (0.53) PLA2G2CLPAR5USP2HTTMCHR1
SCHEMBL18029905 0.95 PLA2G2C (0.46) PLA2G2CLPAR5USP2HTTALDH1A1
SCHEMBL5959107 0.95 PLA2G2C (0.46) PLA2G2CLPAR5USP2HTTALDH1A1
SCHEMBL15986951 0.95 PLA2G2C (0.46) PLA2G2CLPAR5USP2HTTALDH1A1
SCHEMBL6814455 0.93 PLA2G2C (0.47) PLA2G2CLPAR5USP2HTTALDH1A1
SCHEMBL20670986 0.91 PLA2G2C (0.45) PLA2G2CLPAR5USP2HTTALDH1A1

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
EP-1024812-A4 COMPOSITIONS CONTAINING LYSOPHOSPHATIDIC ACIDS WHICH INHIBIT APOPTOSIS AND USES THEREOF SKY HIGH LLC (US) 2004-05-19 EP disclosed
EP-1024812-A1 COMPOSITIONS CONTAINING LYSOPHOSPHATIDIC ACIDS WHICH INHIBIT APOPTOSIS AND USES THEREOF LXR BIOTECHNOLOGY INC. (US) 2000-08-09 EP disclosed
WO-1998041213-A1 COMPOSITIONS CONTAINING LYSOPHOSPHOTIDIC ACIDS WHICH INHIBIT APOPTOSIS AND USES THEREOF LXR BIOTECHNOLOGY INC. (US) 1998-09-24 WO disclosed