SCHEMBL28959762

SCHEMBL28959762

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

nearest known ligand 0.82

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 10/20 0.82
▸ IAPP P10997 5/20 0.72
▸ TOP2A P11388 3/20 0.54
▸ HTR1A P08908 1/20 0.51
▸ TTR P02766 2/20 0.50
▸ PTGS1 P23219 1/20 0.50
▸ DPP4 P27487 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
SCHEMBL9363841 1.00 APP (0.82) APPIAPPTOP2AHTR1ATTR
SCHEMBL9363805 1.00 APP (0.82) APPIAPPTOP2AHTR1ATTR
SCHEMBL9363801 1.00 APP (0.82) APPIAPPTOP2AHTR1ATTR
SCHEMBL9363836 1.00 APP (0.82) APPIAPPTOP2AHTR1ATTR
SCHEMBL9364085 0.99 APP (0.80) APPIAPPTOP2AHTR1ATTR
SCHEMBL9364078 0.99 APP (0.80) APPIAPPTOP2AHTR1ATTR
SCHEMBL19369293 0.90 APP (1.00) APPIAPPTOP2AHTR1ATTR
SCHEMBL10825839 0.90 APP (1.00) APPIAPPTOP2AHTR1ATTR
SCHEMBL10826170 0.90 APP (1.00) APPIAPPTOP2AHTR1ATTR
SCHEMBL21133739 0.90 APP (1.00) APPIAPPTOP2AHTR1ATTR

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
CN-114748518-B Oral preparation containing caffeic acid ester and breviscapine for treating intestinal cancer, and its preparation method 云南生物谷药业股份有限公司 2023-01-10 — — CN disclosed
CN-114748518-A Oral preparation containing caffeic acid ester and breviscapine and preparation method thereof 云南生物谷药业股份有限公司 2022-07-15 — — CN disclosed
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