SCHEMBL25697115

SCHEMBL25697115

CCOC(=O)c1cc2cc(/N=N/c3ccc(Br)cc3OC)cc(OC)c2oc1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.54
▸ MAOB P27338 5/20 0.48
▸ POLB P06746 3/20 0.48
▸ THRB P10828 1/20 0.48
▸ TP53 P04637 1/20 0.46
▸ MAOA P21397 2/20 0.46
▸ ALDH1A1 P00352 4/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ GAA P10253 2/20 0.44
▸ CA12 O43570 2/20 0.44
▸ CA2 P00918 2/20 0.44
▸ CA3 P07451 2/20 0.44
▸ CA4 P22748 2/20 0.44
▸ CA6 P23280 2/20 0.44
▸ CA7 P43166 2/20 0.44
▸ CA9 Q16790 2/20 0.44
▸ CA14 Q9ULX7 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ GLA P06280 1/20 0.44
▸ MEN1 O00255 2/20 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
SCHEMBL25697138 0.87 CA12 (0.52) MAPTMAOBPOLBTP53ALDH1A1
SCHEMBL25697270 0.77 CA12 (0.56) MAPTMAOBPOLBTP53ALDH1A1
SCHEMBL25697110 0.74 MAPT (0.68) MAPTMAOBPOLBTHRBTP53
SCHEMBL25697098 0.73 GPR35 (0.59) MAPTMAOBPOLBMAOAALDH1A1
SCHEMBL30425825 0.73 MAOB (0.56) MAPTMAOBTP53MAOAALDH1A1
SCHEMBL2031480 0.73 KMT2A (0.74) MAPTMAOBPOLBMAOAALDH1A1
SCHEMBL25697207 0.72 MAOB (0.63) MAPTMAOBTP53MAOAALDH1A1
SCHEMBL9319364 0.72 MAOB (0.65) MAPTMAOBPOLBTP53MAOA
SCHEMBL1406760 0.72 MAOB (0.62) MAPTMAOBPOLBMAOAALDH1A1
SCHEMBL30425189 0.71 ALDH1A1 (0.39) MAPTPOLBTHRBTP53ALDH1A1

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-2023094734-A1 LIGANDS SPECIFICALLY TARGETING VESICULAR GLUTAMATE TRANSPORTERS FOR SUPER-RESOLUTION IMAGING Sorbonne Université (FR) 2023-06-01 — — WO disclosed
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