SCHEMBL31458629

SCHEMBL31458629

CC(C)(C)OC(=O)Nc1cc(Cl)ccc1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 12/20 0.54
POLB P06746 1/20 0.54
MEN1 O00255 5/20 0.52
KMT2A Q03164 5/20 0.52
HPGD P15428 2/20 0.52
HSP90AA1 P07900 1/20 0.51
HSP90AB1 P08238 1/20 0.51
KDM4E B2RXH2 1/20 0.50
HIF1A Q16665 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
GAA P10253 2/20 0.47
LMNA P02545 2/20 0.47
TP53 P04637 2/20 0.47
MAPT P10636 2/20 0.47
USP2 O75604 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
CHRNA7 P36544 1/20 0.47
NPC1 O15118 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
SCHEMBL3327166 1.00 KCNMA1 (0.54) KCNMA1POLBMEN1KMT2AHPGD
SCHEMBL4123552 0.88 HSP90AA1 (0.51) KCNMA1POLBMEN1KMT2AHPGD
SCHEMBL31122314 0.88 HSP90AA1 (0.51) KCNMA1POLBMEN1KMT2AHPGD
SCHEMBL3787046 0.87 KMT2A (0.54) MEN1KMT2AHPGDHSP90AA1HSP90AB1
SCHEMBL28738831 0.86 PDK1 (0.56) POLBMEN1KMT2AHPGDHSP90AA1
SCHEMBL4568010 0.84 LMNA (0.56) POLBMEN1KMT2AGAALMNA
SCHEMBL29991673 0.84 LMNA (0.56) POLBMEN1KMT2AGAALMNA
SCHEMBL2031546 0.84 KCNMA1 (0.54) KCNMA1POLBHPGDGAATP53
SCHEMBL7254652 0.83 KCNMA1 (0.61) KCNMA1POLBMEN1KMT2AHPGD
SCHEMBL23954504 0.83 KMT2A (0.47) MEN1KMT2AHPGDHSP90AA1HSP90AB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119661465-A Method for synthesizing chlorzoxazone 山东新时代药业有限公司 2025-03-21 CN disclosed
CN-119661465-A Method for synthesizing chlorzoxazone 山东新时代药业有限公司 2025-03-21 CN disclosed
CN-119661464-A Efficient preparation method of chlorzoxazone 山东新时代药业有限公司 2025-03-21 CN disclosed