SCHEMBL31059249

SCHEMBL31059249

C=CC=CC=CCCC(O)CCCCCCCCCCC

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.42
GPR132 Q9UNW8 1/20 0.42
FFAR4 Q5NUL3 2/20 0.42
FFAR1 O14842 2/20 0.42
GPR84 Q9NQS5 5/20 0.40
FDPS P14324 3/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
FASN P49327 1/20 0.38
NFKB1 P19838 1/20 0.38

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
SCHEMBL28675282 0.93 PPARG (0.46) PPARGGPR132FFAR4FFAR1GPR84
SCHEMBL30570814 0.93 PPARG (0.49) PPARGGPR132FFAR4FFAR1ALDH1A1
SCHEMBL30477427 0.93 PPARG (0.49) PPARGGPR132FFAR4FFAR1ALDH1A1
SCHEMBL7169204 0.93 PPARG (0.49) PPARGGPR132FFAR4FFAR1ALDH1A1
SCHEMBL4171793 0.93 PPARG (0.46) PPARGGPR132FFAR4FFAR1GPR84
SCHEMBL7169207 0.93 PPARG (0.49) PPARGGPR132FFAR4FFAR1ALDH1A1
SCHEMBL7169202 0.93 PPARG (0.49) PPARGGPR132FFAR4FFAR1ALDH1A1
SCHEMBL4165758 0.93 PPARG (0.46) PPARGGPR132FFAR4FFAR1GPR84
SCHEMBL4171797 0.93 PPARG (0.46) PPARGGPR132FFAR4FFAR1GPR84
SCHEMBL27503948 0.93 PPARG (0.49) PPARGGPR132FFAR4FFAR1ALDH1A1

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-118556685-A Bollworm II pheromone and synergistic compound thereof 中国农业科学院植物保护研究所 2024-08-30 CN disclosed