SCHEMBL31395448

SCHEMBL31395448

CC(=O)c1ccc(Oc2ccc(CBr)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.70
▸ HPGD P15428 1/20 0.70
▸ RAB9A P51151 1/20 0.70
▸ MAOB P27338 8/20 0.54
▸ KMT2A Q03164 2/20 0.53
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ MAOA P21397 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ HRH3 Q9Y5N1 1/20 0.48
▸ ESRRA P11474 1/20 0.47
▸ GLA P06280 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ LMNA P02545 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ CES2 O00748 1/20 0.47
▸ CES1 P23141 1/20 0.47

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
SCHEMBL506537 0.88 KMT2A (0.67) MAPTHPGDRAB9AMAOBKMT2A
Bromide SCHEMBL28106863 0.86 KMT2A (0.64) MAPTHPGDRAB9AMAOBKMT2A
SCHEMBL3301210 0.84 HPGD (1.00) MAPTHPGDRAB9AMAOBKMT2A
SCHEMBL203697 0.84 HPGD (1.00) MAPTHPGDRAB9AMAOBKMT2A
SCHEMBL680470 0.83 MAPT (0.73) MAPTHPGDRAB9AMAOBKMT2A
SCHEMBL2839451 0.82 CA1 (0.56) MAPTRAB9AKMT2ASMN1; SMN2
SCHEMBL25175254 0.80 MAPT (0.68) MAPTHPGDRAB9AMAOBKMT2A
SCHEMBL12669454 0.80 MAPT (0.68) MAPTHPGDRAB9AMAOBKMT2A
SCHEMBL4744025 0.80 MAPT (0.68) MAPTHPGDRAB9AMAOBKMT2A
SCHEMBL26327986 0.80 MAPT (0.68) MAPTHPGDRAB9AMAOBKMT2A

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-119470907-A Application of glyoxal-based compound in preparation of probe 深圳湾实验室 2025-02-18 — — CN disclosed
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