SCHEMBL482828

SCHEMBL482828

CCC(CCCCCCCCCC(C(C)=O)C(=O)O)C(CC)(C(C)=O)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.32
FFAR1 O14842 1/20 0.32
HSPD1 P10809 1/20 0.31
BLM P54132 1/20 0.31
HSPE1 P61604 1/20 0.31
MAPT P10636 1/20 0.31
LCK P06239 1/20 0.31
PPARD Q03181 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31

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
SCHEMBL6237466 0.83 FFAR4 (0.44) GPR84FFAR1PPARD
SCHEMBL28161504 0.79 CHRM1 (0.35)
SCHEMBL28657508 0.77 GPR84 (0.46) GPR84FFAR1HSPD1BLMHSPE1
SCHEMBL28646563 0.77 GPR84 (0.46) GPR84FFAR1HSPD1BLMHSPE1
SCHEMBL7873972 0.77 GPR84 (0.46) GPR84FFAR1HSPD1BLMHSPE1
SCHEMBL7050011 0.77 GPR84 (0.46) GPR84FFAR1HSPD1BLMHSPE1
SCHEMBL11461311 0.77 GPR84 (0.46) GPR84FFAR1HSPD1BLMHSPE1
SCHEMBL9346691 0.77 GPR84 (0.46) GPR84FFAR1HSPD1BLMHSPE1
SCHEMBL28645108 0.75 GPR84 (0.42) GPR84FFAR1HSPD1BLMHSPE1
SCHEMBL6922740 0.74 GPR84 (0.44) GPR84FFAR1MAPTLCKPPARD

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
EP-2412696-A1 PROCESS FOR PRODUCTION OF 3-METHYL-CYCLOPENTADECENONE, PROCESS FOR PRODUCTION OF R/S-MUSCONE, AND PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE MUSCONE Doya, Masaharu (JP) 2012-02-01 EP disclosed
US-20110172465-A1 METHOD FOR PRODUCING 3-METHYL-CYCLOPENTADECENONES, METHOD FOR PRODUCING (R)- AND (S)- MUSCONE, AND METHOD FOR PRODUCING OPTICALLY ACTIVE MUSCONE DOYA MASAHARU 2011-07-14 US disclosed