SCHEMBL28070813

SCHEMBL28070813

CCCCCCCCCCCC(=O)CCCCCC(O)CCCCC

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.74
FFAR4 Q5NUL3 2/20 0.74
GPR84 Q9NQS5 8/20 0.63
NFKB1 P19838 1/20 0.60
MAPT P10636 1/20 0.59
KMT2A Q03164 1/20 0.59
FAAH O00519 2/20 0.59
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50

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
SCHEMBL27832074 1.00 FFAR1 (0.74) FFAR1FFAR4GPR84NFKB1MAPT
SCHEMBL4624203 1.00 FFAR1 (0.74) FFAR1FFAR4GPR84NFKB1MAPT
SCHEMBL27832075 0.96 FFAR1 (0.69) FFAR1FFAR4GPR84NFKB1MAPT
SCHEMBL28879409 0.96 FFAR1 (0.69) FFAR1FFAR4GPR84NFKB1MAPT
SCHEMBL28069516 0.96 FFAR1 (0.69) FFAR1FFAR4GPR84NFKB1MAPT
SCHEMBL26624852 0.94 FFAR1 (0.67) FFAR1FFAR4GPR84NFKB1MAPT
SCHEMBL28491245 0.92 FFAR4 (0.89) FFAR1FFAR4GPR84MAPTKMT2A
SCHEMBL28742653 0.92 FFAR1 (0.69) FFAR1FFAR4GPR84NFKB1MAPT
SCHEMBL29074530 0.92 FFAR1 (0.69) FFAR1FFAR4GPR84NFKB1MAPT
SCHEMBL8024625 0.92 FFAR1 (0.69) FFAR1FFAR4GPR84NFKB1MAPT

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
CN-104072455-B 6-aroyl acetyl oxygen base Aurone compound and the application on pesticide thereof 江苏大学 2016-06-15 CN disclosed