SCHEMBL31527950

SCHEMBL31527950

COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2OC)cc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ GAA P10253 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ XDH P47989 4/20 0.45
▸ CYP19A1 P11511 3/20 0.45
▸ STK17B O94768 1/20 0.45
▸ MAPT P10636 3/20 0.44
▸ HPGD P15428 3/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ AGTR1 P30556 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ TUBB4A P04350 1/20 0.43
▸ TUBB P07437 1/20 0.43
▸ TUBA3C P0DPH7 1/20 0.43
▸ TUBA1B P68363 1/20 0.43
▸ TUBA4A P68366 1/20 0.43

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
SCHEMBL26314138 1.00 KDM4E (0.46) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL25434155 0.88 ESR1 (0.50) ALDH1A1MEN1KMT2AXDHCYP19A1
SCHEMBL25434157 0.88 ESR1 (0.50) ALDH1A1MEN1KMT2AXDHCYP19A1
SCHEMBL31162803 0.84 XDH (0.47) ALDH1A1MEN1KMT2AXDHCYP19A1
SCHEMBL31613485 0.84 XDH (0.47) ALDH1A1MEN1KMT2AXDHCYP19A1
SCHEMBL31527839 0.82 ESR1 (0.51) KDM4EALDH1A1MEN1KMT2ACYP19A1
3,4'-O-Dimethylquercetin SCHEMBL25437988 0.81 CYP3A4 (0.60) KDM4EALDH1A1GAAMEN1KMT2A
3,4'-O-Dimethylquercetin SCHEMBL25437986 0.81 CYP3A4 (0.60) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL31162800 0.80 MEN1 (0.56) ALDH1A1MEN1KMT2AXDHCYP19A1
SCHEMBL26314368 0.80 MEN1 (0.56) ALDH1A1MEN1KMT2AXDHCYP19A1

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 1 patent. 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
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