SCHEMBL29156723

SCHEMBL29156723

O=P(c1ccccc1)(c1ccccc1)c1nc2ccccc2c2ccc(Br)cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NCOR2 Q9Y618 2/20 0.42
▸ HDAC3 O15379 1/20 0.42
▸ APP P05067 1/20 0.42
▸ ACHE P22303 1/20 0.42
▸ HDAC4 P56524 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC7 Q8WUI4 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ HDAC10 Q969S8 1/20 0.42
▸ HDAC11 Q96DB2 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ HDAC9 Q9UKV0 1/20 0.42
▸ HDAC5 Q9UQL6 1/20 0.42
▸ RXFP1 Q9HBX9 4/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ ADORA3 P0DMS8 1/20 0.37
▸ IDO1 P14902 1/20 0.37
▸ TDO2 P48775 1/20 0.37

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
SCHEMBL29156772 0.84 GPR3 (0.42) MEN1KMT2AALDH1A1GPR3
SCHEMBL29156674 0.84 MAOA (0.41) MEN1KMT2AIDO1TDO2IDO2
SCHEMBL29156722 0.84 HDAC3 (0.41) HDAC3ACHEHDAC4HDAC1HDAC7
SCHEMBL30744876 0.81 ESR1 (0.40) ADORA3TNKSTNKS2
SCHEMBL29156682 0.80 KCNA5 (0.42) RXFP1MEN1KMT2AATMALDH1A1
SCHEMBL29156683 0.80 MAPT (0.45) MEN1KMT2AATMHTTALDH1A1
SCHEMBL29156703 0.78 MAOA (0.41) MEN1KMT2AHTTALDH1A1GRM2
SCHEMBL29156666 0.75 GPR3 (0.46) NCOR2RXFP1MEN1KMT2AADORA3
SCHEMBL30744952 0.75 TNKS (0.41) MEN1KMT2AHTTTNKSTNKS2
SCHEMBL11280043 0.74 MAPT (0.43) MEN1KMT2AHTTALDH1A1HPGD

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-117534705-A Method for synthesizing phosphoryl heterocyclic aromatic hydrocarbon by photocatalysis 中国科学院理化技术研究所 2024-02-09 — — CN disclosed
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