SCHEMBL31661246

SCHEMBL31661246

CC(=O)Nc1ccc(C(C)=O)nc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
POLB P06746 3/20 0.50
HTT P42858 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KMT2A Q03164 8/20 0.48
MEN1 O00255 6/20 0.48
MAPT P10636 4/20 0.48
TDP1 Q9NUW8 2/20 0.48
CA12 O43570 1/20 0.48
BRD4 O60885 1/20 0.48
NR1I2 O75469 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
MB P02144 1/20 0.48
CYP1A1 P04798 1/20 0.48
CA3 P07451 1/20 0.48
CYP3A4 P08684 1/20 0.48
RARG P13631 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL3621493 0.87 P4HTM (0.63) ALDH1A1SMN1; SMN2POLBHTTL3MBTL1
SCHEMBL17729302 0.87 P4HTM (0.54) ALDH1A1SMN1; SMN2KMT2AP4HTMKDM4E
SCHEMBL1685926 0.85 NAMPT (0.54) ALDH1A1SMN1; SMN2POLBHTTL3MBTL1
SCHEMBL25191218 0.84 SMN1; SMN2 (0.55) ALDH1A1SMN1; SMN2HTTKMT2AMEN1
SCHEMBL31598929 0.84 MAPK1 (0.59) ALDH1A1SMN1; SMN2POLBHTTL3MBTL1
SCHEMBL14429972 0.82 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBL3MBTL1P4HTM
SCHEMBL17984640 0.82 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2POLBHTTL3MBTL1
SCHEMBL29435717 0.82 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2POLBHTTL3MBTL1
Hydrochloric Acid SCHEMBL31680447 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBHTTL3MBTL1
Hydrochloric Acid SCHEMBL22583076 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBHTTL3MBTL1

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
WO-2025151517-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS ASSOCIATED WITH MISSFOLDING OF ALPHA-SYNUCLEIN PROTEIN WAVEBREAK THERAPEUTICS LIMITED (US) 2025-07-17 WO disclosed