SCHEMBL6552277

SCHEMBL6552277

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

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.54
GAA P10253 1/20 0.45
ATM Q13315 1/20 0.45
CYP1A2 P05177 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.37
THRB P10828 1/20 0.37
PMP22 Q01453 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ADRB2 P07550 1/20 0.36
BRD4 O60885 1/20 0.35
FFAR2 O15552 1/20 0.35

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
SCHEMBL6552275 0.87 ALOX15 (0.66) ALOX15GAAATMCYP1A2NPSR1
SCHEMBL5927343 0.85 ALOX15 (0.64) ALOX15GAAATMCYP1A2NPSR1
SCHEMBL11142679 0.85 ALOX15 (0.73) ALOX15CYP1A2NPSR1L3MBTL1CYP2C9
SCHEMBL11143083 0.78 ALOX15 (0.62) ALOX15ATMCYP1A2NPSR1L3MBTL1
SCHEMBL28980075 0.78 ALOX15 (0.45) ALOX15CYP1A2NPSR1L3MBTL1KMT2A
SCHEMBL28980073 0.78 ALOX15 (0.45) ALOX15CYP1A2NPSR1L3MBTL1KMT2A
SCHEMBL29076257 0.72 PGK1 (0.43) ALOX15CYP1A2NPSR1MAPTLMNA
SCHEMBL29098746 0.71 ALOX15 (0.46) ALOX15CYP1A2NPSR1L3MBTL1MAPT
Phosphoric Acid SCHEMBL28073757 0.70 SMN1; SMN2 (0.51) ALOX15CYP1A2NPSR1L3MBTL1KMT2A
Mifobate SCHEMBL635294 0.70 ALOX15 (1.00) ALOX15CYP1A2NPSR1L3MBTL1KMT2A

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