SCHEMBL23212346

SCHEMBL23212346

O=C(O)Oc1cccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 3/20 0.57
▸ ALDH1A1 P00352 5/20 0.56
▸ L3MBTL1 Q9Y468 2/20 0.56
▸ KCNA3 P22001 1/20 0.54
▸ MAPT P10636 6/20 0.51
▸ MEN1 O00255 5/20 0.51
▸ KMT2A Q03164 5/20 0.51
▸ MAPK1 P28482 4/20 0.51
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ LMNA P02545 3/20 0.51
▸ ADORA2A P29274 3/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ HPGD P15428 2/20 0.51
▸ ABCC4 O15439 1/20 0.51
▸ USP2 O75604 1/20 0.51
▸ TP53 P04637 1/20 0.51
▸ HSP90AA1 P07900 1/20 0.51
▸ CHRM2 P08172 1/20 0.51
▸ HSP90AB1 P08238 1/20 0.51
▸ HTR1A P08908 1/20 0.51

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
SCHEMBL1727899 0.94 TTR (0.54) TTRALDH1A1L3MBTL1KCNA3MAPT
SCHEMBL7479718 0.93 ALDH1A1 (0.56) TTRALDH1A1L3MBTL1KCNA3MAPT
SCHEMBL6036890 0.93 ALDH1A1 (0.51) TTRALDH1A1L3MBTL1KCNA3MAPT
SCHEMBL7109053 0.87 ALDH1A1 (0.51) TTRALDH1A1L3MBTL1KCNA3MAPT
SCHEMBL5306728 0.87 MAPT (0.57) TTRALDH1A1L3MBTL1MAPTMEN1
SCHEMBL11524597 0.85 TOP1 (0.66) TTRALDH1A1L3MBTL1KCNA3MAPT
SCHEMBL5311970 0.85 EGFR (0.67) TTRALDH1A1L3MBTL1MAPTMEN1
SCHEMBL8675454 0.84 TTR (0.52) TTRALDH1A1L3MBTL1KCNA3MAPT
SCHEMBL11039554 0.84 ELANE (0.55) TTRALDH1A1L3MBTL1KCNA3MAPT
SCHEMBL11101186 0.84 TTR (0.72) TTRALDH1A1L3MBTL1KCNA3MAPT

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
EP-4041830-A1 THERMALLY CURABLE TWO-COMPONENT COATING COMPOUNDS BASF SE (DE) 2022-08-17 — — EP disclosed
WO-2021069295-A1 THERMALLY CURABLE TWO-COMPONENT COATING COMPOUNDS BASF SE (DE) 2021-04-15 — — WO disclosed
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