SCHEMBL29280346

SCHEMBL29280346

Oc1ccc(Cl)cc1N=Nc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 1.00
CASP3 P42574 1/20 1.00
SENP7 Q9BQF6 1/20 1.00
SENP6 Q9GZR1 1/20 1.00
FTO Q9C0B1 1/20 0.64
NQO2 P16083 2/20 0.54
MEN1 O00255 9/20 0.48
KMT2A Q03164 9/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 5/20 0.47
MAPK1 P28482 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
KDM4E B2RXH2 2/20 0.47
HSP90AA1 P07900 1/20 0.47
NPC1 O15118 3/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CYP3A4 P08684 2/20 0.45
HPGD P15428 2/20 0.45

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
SCHEMBL29280345 1.00 L3MBTL1 (1.00) L3MBTL1CASP3SENP7SENP6FTO
SCHEMBL11624172 0.86 CASP3 (0.74) L3MBTL1CASP3SENP7SENP6FTO
SCHEMBL11624176 0.86 CASP3 (0.74) L3MBTL1CASP3SENP7SENP6FTO
SCHEMBL28321907 0.82 NQO2 (0.73) L3MBTL1CASP3SENP7SENP6FTO
SCHEMBL3909658 0.81 L3MBTL1 (0.68) L3MBTL1CASP3SENP7SENP6FTO
SCHEMBL11568272 0.81 L3MBTL1 (0.68) L3MBTL1CASP3SENP7SENP6FTO
SCHEMBL4660315 0.78 L3MBTL1 (0.63) L3MBTL1CASP3SENP7SENP6FTO
SCHEMBL4660311 0.78 L3MBTL1 (0.63) L3MBTL1CASP3SENP7SENP6FTO
SCHEMBL19970698 0.78 MEN1 (0.72) L3MBTL1CASP3SENP7SENP6FTO
SCHEMBL1275967 0.78 FTO (1.00) L3MBTL1CASP3SENP7SENP6FTO

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-117736159-A Preparation method of chlorzoxazone 九江善水科技股份有限公司 2024-03-22 CN disclosed