SCHEMBL8460650

SCHEMBL8460650

CCCCCCCCCC(OOC(C)(C)C)OC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.45
GPR84 Q9NQS5 7/20 0.41
FFAR1 O14842 2/20 0.41
MAPT P10636 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
CA2 P00918 1/20 0.39
GRIK1 P39086 1/20 0.38
GRIK2 Q13002 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
ZDHHC7 Q9NXF8 1/20 0.37

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
SCHEMBL9842737 1.00 SMPD1 (0.45) SMPD1GPR84FFAR1MAPTLCK
SCHEMBL28506896 0.98 SMPD1 (0.42) SMPD1GPR84FFAR1MAPTLCK
SCHEMBL4938749 0.93 CA2 (0.40) SMPD1GPR84CA2
SCHEMBL29112774 0.89 SMPD1 (0.40) SMPD1GPR84FFAR1MAPTLCK
SCHEMBL8416793 0.89 SMPD1 (0.46) SMPD1GPR84FFAR1MAPTLCK
SCHEMBL22444285 0.89 SMPD1 (0.46) SMPD1GPR84FFAR1MAPTLCK
SCHEMBL9842540 0.88 SMPD1 (0.39) SMPD1GPR84FFAR1MAPTLCK
SCHEMBL28354007 0.86 CTSS (0.35) CA2
SCHEMBL22574602 0.86 LMNA (0.49) SMPD1MAPT
SCHEMBL28326424 0.82 GPR84 (0.52) SMPD1GPR84FFAR1MAPTLCK

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
JP-11228627-A None JP disclosed
JP-H11228627-A PRODUCTION OF PROPYLENIC POLYMER NOF CORP 1999-08-24 JP disclosed