SCHEMBL31162964

SCHEMBL31162964

COCOc1cc(OCOC)c2c(c1)O[C@@H](c1ccc(OC)c(OCOC)c1)[C@H](O)C2=O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.71
▸ XDH P47989 2/20 0.57
▸ ROR1 Q01973 1/20 0.53
▸ MAPT P10636 4/20 0.46
▸ HPGD P15428 4/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ AGTR1 P30556 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ CYP2C9 P11712 4/20 0.46
▸ SLCO1B3 Q9NPD5 4/20 0.46
▸ SLCO1B1 Q9Y6L6 4/20 0.46
▸ CYP3A4 P08684 3/20 0.46
▸ ALOX15 P16050 3/20 0.46
▸ SLCO2B1 O94956 3/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ ALOX12 P18054 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46

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
SCHEMBL23202794 0.92 ALDH1A1 (0.62) ALDH1A1XDHROR1MAPTHPGD
SCHEMBL30350332 0.92 ALDH1A1 (0.62) ALDH1A1XDHROR1MAPTHPGD
SCHEMBL31162814 0.89 ALDH1A1 (0.57) ALDH1A1XDHROR1MAPTHPGD
SCHEMBL25434803 0.87 ALDH1A1 (0.61) ALDH1A1XDHMAPTHPGDKDM4E
SCHEMBL25434797 0.87 ALDH1A1 (0.61) ALDH1A1XDHMAPTHPGDKDM4E
SCHEMBL30576357 0.86 ALDH1A1 (0.54) ALDH1A1XDHROR1HDAC3HDAC4
SCHEMBL31162789 0.86 ALDH1A1 (0.54) ALDH1A1XDHROR1HDAC3HDAC4
SCHEMBL25434717 0.85 ALDH1A1 (0.56) ALDH1A1XDHROR1MAPTHPGD
SCHEMBL25434723 0.85 ALDH1A1 (0.56) ALDH1A1XDHROR1MAPTHPGD
SCHEMBL30576367 0.85 ALDH1A1 (0.56) ALDH1A1XDHROR1MAPTHPGD

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
Send feedback