SCHEMBL25426134

SCHEMBL25426134

O=C1/C(=C/c2ccc(-c3ccccc3)cc2)Oc2cc(O)ccc21

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 7/20 0.79
▸ MAOA P21397 4/20 0.79
▸ TYR P14679 2/20 0.79
▸ MEN1 O00255 6/20 0.71
▸ KMT2A Q03164 6/20 0.71
▸ POLB P06746 1/20 0.71
▸ RAB9A P51151 1/20 0.71
▸ RECQL P46063 2/20 0.67
▸ STK17B O94768 2/20 0.67
▸ KDM4E B2RXH2 1/20 0.67
▸ PSMD14 O00487 1/20 0.67
▸ AURKA O14965 1/20 0.67
▸ NPC1 O15118 1/20 0.67
▸ DAPK3 O43293 1/20 0.67
▸ JAK2 O60674 1/20 0.67
▸ ALPL P05186 1/20 0.67
▸ ALPI P09923 1/20 0.67
▸ GAA P10253 1/20 0.67
▸ MAPT P10636 1/20 0.67
▸ ALPG P10696 1/20 0.67

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
SCHEMBL5707772 0.92 MAOB (0.83) MAOBMAOATYRMEN1KMT2A
SCHEMBL5707779 0.92 MAOB (0.83) MAOBMAOATYRMEN1KMT2A
SCHEMBL29435856 0.89 TYR (1.00) MAOBMAOATYRMEN1KMT2A
SCHEMBL5707753 0.89 TYR (1.00) MAOBMAOATYRMEN1KMT2A
SCHEMBL30214422 0.89 TYR (1.00) MAOBMAOATYRMEN1KMT2A
SCHEMBL30214414 0.85 TYR (0.86) MAOBMAOATYRMEN1KMT2A
SCHEMBL28949991 0.85 TYR (0.86) MAOBMAOATYRMEN1KMT2A
SCHEMBL21046449 0.83 MEN1 (1.00) MAOBMAOATYRMEN1KMT2A
6-Hydroxy-4'-Chloro Aurone SCHEMBL30214387 0.83 ELANE (0.88) MAOBMAOATYRMEN1KMT2A
SCHEMBL19462969 0.83 MAOA (0.83) MAOBMAOATYRMEN1KMT2A

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
WO-2023114761-A2 TARGETING ERO1 ALPHA WITH AURONE DERIVATIVES West Virginia University Board of Governors on behalf of West Virginia University (US) 2023-06-22 — — WO disclosed
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