SCHEMBL31482006

SCHEMBL31482006

O=C(O)c1ccccc1C=C1CC(=O)N(c2ccccc2)C1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 5/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ CFTR P13569 3/20 0.44
▸ GAA P10253 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ TLR9 Q9NR96 1/20 0.43
▸ ALDH1A1 P00352 4/20 0.40
▸ TDP1 Q9NUW8 3/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ HPGD P15428 1/20 0.39
▸ APOBEC3A P31941 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ CASP6 P55212 1/20 0.38
▸ APOBEC3G Q9HC16 1/20 0.38
▸ HDAC1 Q13547 4/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 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
SCHEMBL31482010 0.78 ALDH1A1 (0.44) POLBKDM4EL3MBTL1MAPTCFTR
SCHEMBL28650531 0.77 KDM4E (0.65) POLBKDM4EL3MBTL1MAPTGAA
SCHEMBL31482024 0.75 CASP6 (0.46) KDM4EMAPTGAAALDH1A1MEN1
SCHEMBL22728275 0.72 GAA (0.53) POLBKDM4EL3MBTL1MAPTGAA
SCHEMBL31481990 0.71 CASP6 (0.52) POLBMAPTGAAALDH1A1MEN1
SCHEMBL11043255 0.69 GAA (0.49) POLBKDM4EL3MBTL1MAPTGAA
SCHEMBL11053631 0.68 TDP1 (0.43) POLBKDM4EL3MBTL1MAPTCFTR
SCHEMBL31481999 0.67 CASP6 (0.57) POLBKDM4EL3MBTL1MAPTGAA
SCHEMBL9786540 0.66 GAA (0.53) POLBKDM4EL3MBTL1MAPTGAA
SCHEMBL22580612 0.65 MEN1 (0.64) POLBMAPTGAAPKMTLR9

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
WO-2025080049-A1 COMPOUND FOR INHIBITING ATX, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR USE IN PREVENTING OR TREATING ATX ACTIVITY-RELATED DISEASES CONTAINING SAME AS ACTIVE INGREDIENT 한국화학연구원 2025-04-17 — — WO claimed
WO-2025080049-A1 COMPOUND FOR INHIBITING ATX, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR USE IN PREVENTING OR TREATING ATX ACTIVITY-RELATED DISEASES CONTAINING SAME AS ACTIVE INGREDIENT 한국화학연구원 2025-04-17 — — WO disclosed
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