SCHEMBL8162874

SCHEMBL8162874

COc1ccc(C=CC(=O)CCCCc2ccccc2)cc1OCc1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.76
▸ APP P05067 6/20 0.61
▸ KDM4E B2RXH2 3/20 0.59
▸ ALDH1A1 P00352 3/20 0.59
▸ AKR1C3 P42330 2/20 0.59
▸ PDE4A P27815 1/20 0.58
▸ PDE4B Q07343 1/20 0.58
▸ PDE4C Q08493 1/20 0.58
▸ PDE4D Q08499 1/20 0.58
▸ LMNA P02545 1/20 0.57
▸ HPGD P15428 2/20 0.57
▸ HTT P42858 1/20 0.57
▸ TTR P02766 1/20 0.56
▸ GSK3B P49841 1/20 0.56
▸ MMP1 P03956 1/20 0.56
▸ MMP2 P08253 1/20 0.56
▸ MMP3 P08254 1/20 0.56
▸ MMP9 P14780 1/20 0.56
▸ MMP12 P39900 1/20 0.56
▸ MMP13 P45452 1/20 0.56

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
SCHEMBL8162868 1.00 ALOX5 (0.76) ALOX5APPKDM4EALDH1A1AKR1C3
SCHEMBL8162302 0.96 ALOX5 (0.76) ALOX5APPKDM4EALDH1A1AKR1C3
SCHEMBL8162304 0.96 ALOX5 (0.76) ALOX5APPKDM4EALDH1A1AKR1C3
SCHEMBL8168383 0.93 ALOX5 (0.68) ALOX5APPKDM4EALDH1A1AKR1C3
SCHEMBL8168381 0.93 ALOX5 (0.68) ALOX5APPKDM4EALDH1A1AKR1C3
SCHEMBL29489703 0.92 ALOX5 (0.84) ALOX5APPKDM4EALDH1A1AKR1C3
SCHEMBL29489695 0.86 ALOX5 (0.83) ALOX5APPKDM4EALDH1A1AKR1C3
SCHEMBL30219096 0.86 ALOX5 (1.00) ALOX5APPKDM4EALDH1A1LMNA
SCHEMBL9534542 0.86 ALOX5 (0.83) ALOX5APPKDM4EALDH1A1AKR1C3
SCHEMBL9534555 0.86 ALOX5 (0.83) ALOX5APPKDM4EALDH1A1AKR1C3

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
EP-0974573-A1 PHENYLPROPENONE COMPOUNDS AND MEDICINES CONTAINING THE SAME Kabushiki Kaisha Yakult Honsha (JP) 2000-01-26 — — EP disclosed
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