SCHEMBL24844742

SCHEMBL24844742

COc1ccc(OC(=O)COc2ccc(I)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 4/20 0.73
▸ LMNA P02545 1/20 0.73
▸ TDP1 Q9NUW8 2/20 0.56
▸ APP P05067 3/20 0.53
▸ L3MBTL1 Q9Y468 3/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ MAPT P10636 2/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ HPGD P15428 1/20 0.46
▸ RAB9A P51151 1/20 0.46

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
SCHEMBL24844736 0.85 GAA (0.76) GAALMNATDP1APPL3MBTL1
SCHEMBL24844739 0.85 GAA (0.76) GAALMNATDP1L3MBTL1MAPT
SCHEMBL29207076 0.83 GAA (0.73) GAALMNATDP1L3MBTL1NPC1
SCHEMBL2131505 0.82 PTGS2 (0.57) GAALMNAL3MBTL1MAPTSMN1; SMN2
SCHEMBL29007321 0.80 MAPT (0.64) APPL3MBTL1NPC1MAPTSMN1; SMN2
SCHEMBL8832017 0.78 GAA (0.66) GAALMNATDP1MAPTKMT2A
SCHEMBL12061812 0.78 GAA (0.66) GAALMNAL3MBTL1NPC1MAPT
SCHEMBL1550742 0.76 GAA (0.66) GAALMNATDP1L3MBTL1NPC1
SCHEMBL4960786 0.75 GAA (0.62) GAALMNATDP1L3MBTL1MAPT
SCHEMBL15895195 0.75 PTPN1 (0.50) GAALMNATDP1APPL3MBTL1

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
US-20230002679-A1 COMPOUND AND LIQUID CRYSTAL COMPOSITION FUJIFILM CORPORATION (JP) 2023-01-05 — — US disclosed
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