SCHEMBL31168827

SCHEMBL31168827

Brc1ccc2c(c1)Nc1ccccc1O2

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 9/20 0.65
▸ AHR P35869 3/20 0.59
▸ HTR2B P41595 2/20 0.47
▸ HTR7 P34969 1/20 0.47
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ GAA P10253 2/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ LMNA P02545 1/20 0.40
▸ ALPL P05186 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ ALPI P09923 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ALPG P10696 1/20 0.40
▸ TLR9 Q9NR96 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL11536877 1.00 ALOX5 (0.65) ALOX5AHRHTR2BHTR7MEN1
SCHEMBL13833013 0.89 ALOX5 (0.65) ALOX5AHRHTR2BHTR7MEN1
SCHEMBL30839233 0.89 ALOX5 (0.65) ALOX5AHRHTR2BHTR7MEN1
SCHEMBL46736 0.86 AHR (0.56) ALOX5AHRHTR2BHTR7MEN1
SCHEMBL28916089 0.86 ALOX5 (0.57) ALOX5AHRHTR2BHTR7MEN1
Phenoxazine SCHEMBL28844098 0.81 ALOX5 (1.00) ALOX5HTR2BHTR7MEN1KMT2A
Phenoxazine SCHEMBL29355714 0.81 ALOX5 (1.00) ALOX5HTR2BHTR7MEN1KMT2A
Phenoxazine SCHEMBL7862 0.81 ALOX5 (1.00) ALOX5HTR2BHTR7MEN1KMT2A
Phenoxazine SCHEMBL6310178 0.81 ALOX5 (1.00) ALOX5HTR2BHTR7MEN1KMT2A
SCHEMBL3409888 0.80 AHR (0.49) ALOX5AHRMEN1KMT2ALMNA

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-111560031-B Polycyclic aromatic compounds and uses thereof 学校法人关西学院 2024-11-29 — — CN disclosed
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