SCHEMBL28046741

SCHEMBL28046741

CCCCCCCCc1c(C)cccc1OP(=O)(O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.46
INPPL1 O15357 1/20 0.45
INPP5B P32019 1/20 0.45
INPP5A Q14642 1/20 0.45
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
ENPP2 Q13822 1/20 0.42
PPARA Q07869 2/20 0.42
SLC2A1 P11166 1/20 0.40
PPARG P37231 1/20 0.40
ALOX5 P09917 1/20 0.40
PTGS2 P35354 1/20 0.40
CXCR5 P32302 1/20 0.39
S1PR2 O95136 2/20 0.39
S1PR4 O95977 2/20 0.39
S1PR1 P21453 2/20 0.39
S1PR3 Q99500 2/20 0.39
CETP P11597 5/20 0.39
THRA P10827 1/20 0.38

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
SCHEMBL518009 0.87 PPARA (0.50) PLK1INPPL1INPP5BINPP5AHTR2A
SCHEMBL6445625 0.87 PPARA (0.50) PLK1INPPL1INPP5BINPP5AHTR2A
SCHEMBL29790850 0.87 PPARA (0.50) PLK1INPPL1INPP5BINPP5AHTR2A
SCHEMBL4445998 0.87 PPARA (0.50) PLK1INPPL1INPP5BINPP5AHTR2A
SCHEMBL6281614 0.87 PPARA (0.50) PLK1INPPL1INPP5BINPP5AHTR2A
SCHEMBL9808679 0.87 PPARA (0.47) PLK1INPPL1INPP5BINPP5AHTR2A
SCHEMBL4440545 0.87 PPARA (0.50) PLK1INPPL1INPP5BINPP5AHTR2A
SCHEMBL4442481 0.87 PPARA (0.50) PLK1INPPL1INPP5BINPP5AHTR2A
SCHEMBL6285550 0.87 PPARA (0.50) PLK1INPPL1INPP5BINPP5AHTR2A
SCHEMBL30954288 0.87 PPARA (0.50) PLK1INPPL1INPP5BINPP5AHTR2A

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
CN-103818937-B From containing the method producing beryllium oxide or high-purity beryllium oxide beryllium solution XINJIANG Research Institute OF NON FERROUS METALS (CN) 2016-01-13 CN claimed
CN-103818937-B From containing the method producing beryllium oxide or high-purity beryllium oxide beryllium solution XINJIANG Research Institute OF NON FERROUS METALS (CN) 2016-01-13 CN disclosed