SCHEMBL31162783

SCHEMBL31162783

CCO[C@@H]1C(=O)c2c(O)cc(O)cc2O[C@H]1c1ccc(OC)c(O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 6/20 0.56
▸ MAPT P10636 5/20 0.56
▸ CYP2C9 P11712 5/20 0.56
▸ HSD17B10 Q99714 4/20 0.56
▸ XDH P47989 3/20 0.56
▸ TP53 P04637 3/20 0.56
▸ HIF1A Q16665 3/20 0.56
▸ HPGD P15428 3/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ CYP19A1 P11511 2/20 0.56
▸ CYP1A2 P05177 2/20 0.56
▸ MAPK1 P28482 2/20 0.56
▸ TSHR P16473 2/20 0.56
▸ CYP2C19 P33261 2/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ PKM P14618 1/20 0.56
▸ NPC1 O15118 1/20 0.56
▸ CA12 O43570 1/20 0.56
▸ KDM1A O60341 1/20 0.56
▸ CYP1A1 P04798 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
SCHEMBL26314377 1.00 CYP3A4 (0.56) CYP3A4MAPTCYP2C9HSD17B10XDH
3,4'-O-Dimethylquercetin SCHEMBL25437988 0.89 CYP3A4 (0.60) CYP3A4MAPTCYP2C9HSD17B10XDH
3,4'-O-Dimethylquercetin SCHEMBL25437986 0.89 CYP3A4 (0.60) CYP3A4MAPTCYP2C9HSD17B10XDH
SCHEMBL31527913 0.87 CBS (0.61) CYP3A4MAPTCYP2C9HSD17B10XDH
SCHEMBL23085410 0.85 MEN1 (0.67) CYP3A4MAPTCYP2C9HSD17B10XDH
SCHEMBL10610491 0.85 MEN1 (0.67) CYP3A4MAPTCYP2C9HSD17B10XDH
Tamaraxetin SCHEMBL18235875 0.83 CYP3A4 (0.73) CYP3A4MAPTCYP2C9HSD17B10XDH
Tamaraxetin SCHEMBL16887881 0.83 CYP3A4 (0.73) CYP3A4MAPTCYP2C9HSD17B10XDH
Tamaraxetin SCHEMBL30256267 0.83 CYP3A4 (0.73) CYP3A4MAPTCYP2C9HSD17B10XDH
SCHEMBL31162800 0.81 MEN1 (0.56) CYP3A4MAPTCYP2C9HSD17B10XDH

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
US-20250134146-A1 FLAVANONE COMPOUNDS AND THEIR USE AS FLAVOR MODIFIERS FIRMENICH INCORPORATED (US) 2025-05-01 — — US disclosed
CN-118829632-A Flavanone compounds and their use as flavor modifiers 弗门尼舍公司 2024-10-22 — — CN disclosed
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