SCHEMBL29664009

SCHEMBL29664009

COc1cc(OC)c(C(=O)CC(C)C)c(O)c1C

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.61
FASN P49327 1/20 0.52
FFAR1 O14842 2/20 0.51
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
GFER P55789 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GRM2 Q14416 1/20 0.40

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
Aspidinol C SCHEMBL29761934 0.89 FASN (0.67) CYP3A4FASNFFAR1MEN1KMT2A
SCHEMBL11420620 0.79 CYP3A4 (0.67) CYP3A4FASNFFAR1MEN1POLB
SCHEMBL13601793 0.76 CYP3A4 (1.00) CYP3A4FASNMEN1POLBMAPT
SCHEMBL28047696 0.76 FFAR1 (0.57) CYP3A4FFAR1MEN1MAPTHPGD
SCHEMBL28047701 0.75 CYP3A4 (0.61) CYP3A4FFAR1MAPTKMT2A
SCHEMBL9752800 0.74 FFAR1 (0.62) FASNFFAR1TDP1GRM2
SCHEMBL29287621 0.73 FFAR1 (0.79) FASNFFAR1
SCHEMBL26298769 0.73 MAPT (0.64) CYP3A4FASNMEN1POLBMAPT
SCHEMBL28047801 0.70 FFAR1 (0.62) CYP3A4FFAR1POLBMAPTHPGD
SCHEMBL11422414 0.69 FFAR1 (0.43) FFAR1HPGDTDP1

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
WO-2025129053-A1 METHODS AND COMPOSITIONS FOR BIOPRODUCTION OF PHLOROGLUCINOL Debut Biotechnology, Inc. (US) 2025-06-19 WO disclosed
CN-112812868-B Application of SDR family oxidoreductase E26 as emulsifier 南京工业大学 2022-05-17 CN disclosed