SCHEMBL9364085

SCHEMBL9364085

CCCCCC(=O)CC(=O)C=Cc1ccc(O)c(O)c1

nearest known ligand 0.80

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 10/20 0.80
▸ IAPP P10997 5/20 0.74
▸ TOP2A P11388 2/20 0.52
▸ HTR1A P08908 1/20 0.52
▸ TTR P02766 2/20 0.51
▸ PTGS1 P23219 1/20 0.51
▸ DPP4 P27487 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51

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
SCHEMBL9364078 1.00 APP (0.80) APPIAPPTOP2AHTR1ATTR
SCHEMBL9363805 0.99 APP (0.82) APPIAPPTOP2AHTR1ATTR
SCHEMBL28959762 0.99 APP (0.82) APPIAPPTOP2AHTR1ATTR
SCHEMBL9363801 0.99 APP (0.82) APPIAPPTOP2AHTR1ATTR
SCHEMBL9363836 0.99 APP (0.82) APPIAPPTOP2AHTR1ATTR
SCHEMBL9363841 0.99 APP (0.82) APPIAPPTOP2AHTR1ATTR
SCHEMBL9359994 0.90 IAPP (0.80) APPIAPPTOP2ATTRPTGS1
SCHEMBL9360000 0.90 IAPP (0.80) APPIAPPTOP2ATTRPTGS1
SCHEMBL8847524 0.90 APP (0.97) APPIAPPHTR1ATTRPTGS1
SCHEMBL9681899 0.90 APP (0.97) APPIAPPHTR1ATTRPTGS1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117347513-A Method for screening banana salt stress response differential metabolites based on metabonomics technology 中国热带农业科学院热带作物品种资源研究所 2024-01-05 — — CN disclosed
EP-0402469-B1 CATECHOL COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATION CONTAINING SAME TERUMO CORP (JP) 1994-06-01 — — EP disclosed
EP-0402469-A1 CATECHOL COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATION CONTAINING SAME TERUMO KABUSHIKI KAISHA (JP) 1990-12-19 — — EP disclosed
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