SCHEMBL6441076

SCHEMBL6441076

CCCCCC(CC)c1cccc(P(O)O)c1C(CC)CCCCC

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.35
CYSLTR2 Q9NS75 1/20 0.35
CYSLTR1 Q9Y271 1/20 0.35
CSNK1E P49674 1/20 0.33
CNR2 P34972 1/20 0.32
SLC37A4 O43826 1/20 0.32
SOAT1 P35610 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
EPHX2 P34913 1/20 0.30
KCNH2 Q12809 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
SCHEMBL31170749 0.79 MEN1 (0.41) NR1I2CYSLTR2CYSLTR1SLC37A4SOAT1
SCHEMBL9445858 0.77 NR1I2 (0.37) NR1I2CYSLTR2CYSLTR1SLC37A4EPHX2
SCHEMBL6283436 0.77 NR1I2 (0.37) NR1I2CYSLTR2CYSLTR1SLC37A4SOAT1
SCHEMBL8524531 0.75 NR1I2 (0.45) NR1I2CYSLTR2CYSLTR1CSNK1ECNR2
SCHEMBL6442052 0.74 FDPS (0.37) NR1I2CYSLTR2CYSLTR1
SCHEMBL4451585 0.73 PPARG (0.34) NR1I2CYSLTR2CYSLTR1SLC37A4PRSS1
SCHEMBL16054188 0.73 MEN1 (0.42) NR1I2SLC37A4
SCHEMBL4451584 0.72 NR1I2 (0.34) NR1I2CYSLTR2CYSLTR1CNR2SLC37A4
SCHEMBL6287420 0.72 CYSLTR2 (0.32) NR1I2CYSLTR2CYSLTR1
SCHEMBL5164981 0.71 CYSLTR2 (0.41) NR1I2CYSLTR2CYSLTR1SLC37A4PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6956072-B1 Thermoplastic resin composition and molded object thereof POLYPLASTICS CO., LTD. (JP) 2005-10-18 US disclosed