SCHEMBL26623306

SCHEMBL26623306

COc1nccc2cc(I)n(S(=O)(=O)c3ccc(C)cc3)c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ NOD1 Q9Y239 3/20 0.38
▸ HTT P42858 3/20 0.38
▸ ALDH3A1 P30838 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ NOD2 Q9HC29 2/20 0.36
▸ CXCL8 P10145 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ CD4 P01730 2/20 0.35
▸ MAPT P10636 4/20 0.35
▸ KDM4E B2RXH2 4/20 0.35
▸ TSHR P16473 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34

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
SCHEMBL16340138 0.78 ABL1 (0.36) L3MBTL1NOD1HTTALDH3A1POLB
SCHEMBL26623444 0.76 L3MBTL1 (0.53) L3MBTL1NOD1HTTALDH3A1POLB
SCHEMBL26623445 0.76 MEN1 (0.37) NOD1HTTALDH3A1POLBNOD2
SCHEMBL30743357 0.74 HTT (0.44) L3MBTL1NOD1HTTALDH3A1POLB
SCHEMBL31590154 0.74 SCN9A (0.35) L3MBTL1HTTALDH3A1POLBMAPT
SCHEMBL1777233 0.73 PTGDR2 (0.42) L3MBTL1NOD1HTTALDH3A1POLB
SCHEMBL27041345 0.73 L3MBTL1 (0.40) L3MBTL1NOD1HTTALDH3A1POLB
SCHEMBL5411150 0.73 L3MBTL1 (0.38) L3MBTL1NOD1HTTALDH3A1POLB
SCHEMBL1749134 0.72 L3MBTL1 (0.58) L3MBTL1NOD1HTTALDH3A1POLB
SCHEMBL1749156 0.69 PTGDR2 (0.46) L3MBTL1NOD1HTTALDH3A1POLB

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-2023215559-A1 COMPOUNDS, COMPOSITIONS, AND METHODS ARIA PHARMACEUTICALS, INC. (US) 2023-11-09 — — WO disclosed
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