SCHEMBL28538262

SCHEMBL28538262

CCCCc1cccc(C2OC(=O)COC2=O)c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
S1PR3 Q99500 1/20 0.38
XIAP P98170 1/20 0.36
SPHK2 Q9NRA0 3/20 0.36
SPHK1 Q9NYA1 2/20 0.36
PLA2G6 O60733 2/20 0.35
PLA2G4A P47712 1/20 0.35
LPL P06858 3/20 0.34
LIPG Q9Y5X9 3/20 0.34
CTSD P07339 1/20 0.33
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
DRD4 P21917 1/20 0.33
DRD5 P21918 1/20 0.33
DRD3 P35462 1/20 0.33
ABCB1 P08183 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
SCHEMBL28546594 0.92 DRD2 (0.40) S1PR3PLA2G6PLA2G4ADRD2DRD1
SCHEMBL28541784 0.87 MGLL (0.35)
SCHEMBL28547883 0.84 SPHK1 (0.38) SPHK1PLA2G6PLA2G4A
SCHEMBL28910725 0.76 CYP19A1 (0.43)
SCHEMBL28545968 0.75 MGLL (0.35) PLA2G6PLA2G4ALPLLIPG
SCHEMBL28548167 0.74 CYSLTR2 (0.38) LIPGABCB1
SCHEMBL28542552 0.74 MDM2 (0.40)
SCHEMBL28352774 0.73 ALDH1A1 (0.55) S1PR3XIAPPLA2G6PLA2G4A
SCHEMBL9303316 0.72 ALDH1A1 (0.43)
SCHEMBL28545946 0.72 MEN1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109553708-B Catalyst component for olefin polymerization and preparation method thereof 中国石油化工股份有限公司 2021-04-13 CN claimed
CN-109553709-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-04-13 CN claimed
CN-109553707-B Catalyst component for olefin polymerization, catalyst and application 中国石油化工股份有限公司 2021-04-09 CN claimed
CN-109553708-B Catalyst component for olefin polymerization and preparation method thereof 中国石油化工股份有限公司 2021-04-13 CN disclosed
CN-109553709-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-04-13 CN disclosed
CN-109553707-B Catalyst component for olefin polymerization, catalyst and application 中国石油化工股份有限公司 2021-04-09 CN disclosed