SCHEMBL31613485

SCHEMBL31613485

COc1ccc(C2Oc3cccc(O)c3C(=O)C2OC)cc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 4/20 0.47
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ CYP19A1 P11511 3/20 0.45
▸ TP53 P04637 2/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ CA12 O43570 1/20 0.45
▸ KDM1A O60341 1/20 0.45
▸ CYP1A1 P04798 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ CA4 P22748 1/20 0.45

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
SCHEMBL31162803 1.00 XDH (0.47) XDHMEN1KMT2ACYP19A1TP53
SCHEMBL31088169 0.89 MEN1 (0.59) XDHMEN1KMT2ACYP19A1TP53
3,4'-O-Dimethylquercetin SCHEMBL25437988 0.87 CYP3A4 (0.60) XDHMEN1KMT2ACYP19A1TP53
3,4'-O-Dimethylquercetin SCHEMBL25437986 0.87 CYP3A4 (0.60) XDHMEN1KMT2ACYP19A1TP53
SCHEMBL31088180 0.87 XDH (0.61) XDHMEN1KMT2ATP53CYP3A4
SCHEMBL26314368 0.86 MEN1 (0.56) XDHMEN1KMT2ACYP19A1TP53
SCHEMBL31162800 0.86 MEN1 (0.56) XDHMEN1KMT2ACYP19A1TP53
SCHEMBL31527950 0.84 KDM4E (0.46) XDHMEN1KMT2ACYP19A1TP53
SCHEMBL26314138 0.84 KDM4E (0.46) XDHMEN1KMT2ACYP19A1TP53
SCHEMBL31527886 0.84 CBS (0.50) XDHMEN1KMT2ACYP19A1CYP3A4

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
WO-2025202256-A1 COOLING COMPOSITION FIRMENICH SA (CH) 2025-10-02 — — WO disclosed
EP-4583718-A1 FLAVONOID COMPOSITIONS AND USES THEREOF Firmenich SA (CH) 2025-07-16 — — EP disclosed
CN-120129464-A Flavonoid compound and application thereof 弗门尼舍有限公司 2025-06-10 — — CN disclosed
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