SCHEMBL31400944

SCHEMBL31400944

Nc1ccc(-c2c3cc(O)c(=O)cc-3oc3cc(O)c(O)cc23)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.72
MEN1 O00255 6/20 0.64
POLB P06746 6/20 0.64
KMT2A Q03164 6/20 0.64
MAPT P10636 6/20 0.64
USP2 O75604 5/20 0.64
GAA P10253 5/20 0.64
L3MBTL1 Q9Y468 5/20 0.64
BLM P54132 5/20 0.64
KDM4E B2RXH2 5/20 0.64
RECQL P46063 4/20 0.64
TDP1 Q9NUW8 4/20 0.64
MAPK1 P28482 4/20 0.64
THRB P10828 3/20 0.64
MET P08581 1/20 0.61
HPGD P15428 5/20 0.57
ALDH1A1 P00352 4/20 0.57
ALOX12 P18054 3/20 0.57
ABL1 P00519 2/20 0.57
RIN1 Q13671 2/20 0.57

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
SCHEMBL2860609 0.86 MEN1 (0.76) ACHEMEN1POLBKMT2AMAPT
SCHEMBL29588932 0.86 MEN1 (0.76) ACHEMEN1POLBKMT2AMAPT
SCHEMBL29407268 0.85 ACHE (0.69) ACHEMEN1POLBKMT2AMAPT
SCHEMBL19636311 0.84 ACHE (1.00) ACHEMEN1POLBKMT2AMAPT
SCHEMBL31400982 0.83 MEN1 (0.67) ACHEMEN1POLBKMT2AMAPT
SCHEMBL16749070 0.81 MEN1 (0.68) ACHEMEN1POLBKMT2AMAPT
SCHEMBL13320834 0.78 MEN1 (1.00) ACHEMEN1POLBKMT2AMAPT
SCHEMBL30319388 0.78 MEN1 (1.00) ACHEMEN1POLBKMT2AMAPT
SCHEMBL30367913 0.78 MEN1 (1.00) ACHEMEN1POLBKMT2AMAPT
SCHEMBL31481984 0.77 MEN1 (0.61) ACHEMEN1POLBKMT2AMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119780079-B Method for detecting heavy metal trivalent antimony ions/hexavalent chromium ions in environment based on color reagent 南京师范大学 2025-05-30 CN disclosed
CN-119780079-A Method for detecting heavy metal trivalent antimony ions/hexavalent chromium ions in environment based on color reagent 南京师范大学 2025-04-08 CN disclosed