SCHEMBL6552275

SCHEMBL6552275

CC(C)OP(=O)(OC(C)C)C(OP(=O)(OC(c1ccc(Cl)cc1)P(=O)(OC(C)C)OC(C)C)OC(c1ccc(Cl)cc1)P(=O)(OC(C)C)OC(C)C)c1ccc(Cl)cc1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.66
GAA P10253 1/20 0.41
ATM Q13315 1/20 0.41
KMT2A Q03164 5/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ADRB2 P07550 1/20 0.38
MEN1 O00255 4/20 0.35
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.33
BRD4 O60885 1/20 0.33
FFAR2 O15552 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC6A4 P31645 1/20 0.33

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
SCHEMBL5927343 0.98 ALOX15 (0.64) ALOX15GAAATMKMT2AL3MBTL1
SCHEMBL6552277 0.87 ALOX15 (0.54) ALOX15GAAATMKMT2AL3MBTL1
Mifobate SCHEMBL635294 0.79 ALOX15 (1.00) ALOX15KMT2AL3MBTL1CYP1A2NPSR1
SCHEMBL5926564 0.76 ALOX15 (0.60) ALOX15GAAKMT2AL3MBTL1MEN1
SCHEMBL5926986 0.73 ALOX15 (0.75) ALOX15GAAKMT2AL3MBTL1MEN1
SCHEMBL5927416 0.73 ALOX15 (0.57) ALOX15GAAKMT2AL3MBTL1NPSR1
SCHEMBL11142679 0.71 ALOX15 (0.73) ALOX15KMT2AL3MBTL1CYP1A2CYP2C9
SCHEMBL5927287 0.71 ALOX15 (0.81) ALOX15ATMKMT2AL3MBTL1CYP1A2
SCHEMBL8161226 0.69 MMP2 (0.56) ALOX15GAAATMKMT2AL3MBTL1
SCHEMBL30266268 0.68 ALOX15 (0.65) ALOX15KMT2AL3MBTL1CYP1A2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1485106-A2 PHOSPHONATE-PHOSPHATE AND DIPHOSPHONATE APOLIPOPROTEIN E MODULATORS Ilex Products, Inc. (US) 2004-12-15 EP claimed
WO-2003070179-A2 PHOSPHONATE-PHOSPHATE AND DIPHOSPHONATE APOLIPOPROTEIN E MODULATORS ILEX PRODUCTS, INC. (US) 2003-08-28 WO claimed