SCHEMBL31414970

SCHEMBL31414970

O=C(c1ccccc1)c1ccccc1CO.[Na]

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 1/20 0.55
▸ GAA P10253 2/20 0.52
▸ MAPT P10636 1/20 0.52
▸ L3MBTL1 Q9Y468 3/20 0.51
▸ LMNA P02545 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ ALDH1A1 P00352 4/20 0.50
▸ CYP19A1 P11511 1/20 0.50
▸ TSHR P16473 1/20 0.44
▸ ATM Q13315 3/20 0.44
▸ CDC25B P30305 1/20 0.44
▸ TDP1 Q9NUW8 2/20 0.43
▸ SRD5A2 P31213 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ CCR6 P51684 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ TLR9 Q9NR96 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
SCHEMBL29898649 0.98 AKR1C3 (0.57) AKR1C3GAAMAPTL3MBTL1LMNA
SCHEMBL417620 0.98 AKR1C3 (0.57) AKR1C3GAAMAPTL3MBTL1LMNA
Methoxymethane SCHEMBL28769085 0.91 AKR1C3 (0.50) AKR1C3GAAMAPTL3MBTL1LMNA
Fumaric Acid SCHEMBL11348511 0.89 AKR1C3 (0.48) AKR1C3GAAMAPTL3MBTL1LMNA
Maleic Acid SCHEMBL11227321 0.89 AKR1C3 (0.48) AKR1C3GAAMAPTL3MBTL1LMNA
SCHEMBL11036287 0.85 AKR1C3 (0.61) AKR1C3GAAMAPTL3MBTL1ALDH1A1
SCHEMBL9668760 0.85 GAA (0.55) AKR1C3GAAMAPTL3MBTL1LMNA
SCHEMBL27683039 0.85 AKR1C3 (0.44) AKR1C3GAAMAPTL3MBTL1LMNA
SCHEMBL28423359 0.83 AKR1C3 (0.59) AKR1C3GAAMAPTL3MBTL1ALDH1A1
SCHEMBL16244954 0.83 AKR1C3 (0.50) AKR1C3GAAMAPTL3MBTL1LMNA

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
CN-119584951-A Composition comprising a UV filter stabilizer 西姆莱斯股份公司 2025-03-07 — — CN disclosed
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