SCHEMBL4451585

SCHEMBL4451585

CCCCCC(CC)c1cccc(OPO)c1C(CC)CCCCC

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.34
CYSLTR2 Q9NS75 3/20 0.33
CYSLTR1 Q9Y271 3/20 0.33
NR1I2 O75469 1/20 0.33
SLC37A4 O43826 1/20 0.32
ALOX5 P09917 1/20 0.32
PTGS2 P35354 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
PPARA Q07869 2/20 0.31
DHFR P00374 1/20 0.30
EGFR P00533 1/20 0.30

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
SCHEMBL4451584 0.89 NR1I2 (0.34) PPARGCYSLTR2CYSLTR1NR1I2SLC37A4
SCHEMBL5164981 0.79 CYSLTR2 (0.41) PPARGCYSLTR2CYSLTR1NR1I2SLC37A4
SCHEMBL4453788 0.79 INPPL1 (0.40) PPARGCYSLTR2CYSLTR1NR1I2
SCHEMBL4453787 0.78 NR1I2 (0.35) PPARGCYSLTR2CYSLTR1NR1I2SLC37A4
SCHEMBL31170749 0.76 MEN1 (0.41) PPARGCYSLTR2CYSLTR1NR1I2SLC37A4
SCHEMBL6281611 0.75 INPPL1 (0.41) PPARG
SCHEMBL6283436 0.74 NR1I2 (0.37) CYSLTR2CYSLTR1NR1I2SLC37A4PRSS1
SCHEMBL9445858 0.74 NR1I2 (0.37) CYSLTR2CYSLTR1NR1I2SLC37A4
SCHEMBL6441076 0.73 NR1I2 (0.35) CYSLTR2CYSLTR1NR1I2SLC37A4PRSS1
SCHEMBL7784135 0.73 PPARG (0.40) PPARGCYSLTR2CYSLTR1NR1I2PTGS2

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
US-20090027586-A1 Thermoplastic Resin Composition, and Liquid Crystal Display Component Thereof or Information Recording Media Component Thereof POLYPLASTICS CO., LTD. (JP) 2009-01-29 US disclosed
EP-1992666-A1 THERMOPLASTIC RESIN COMPOSITION AND LIQUID CRYSTAL DISPLAY PART OR INFORMATION RECORDING MEDIUM PART USING THE COMPOSITION Polyplastics Co., Ltd. (JP) 2008-11-19 EP disclosed