SCHEMBL9313367

SCHEMBL9313367

O=C(COc1ccc(O)cc1)Oc1ccc(O)cc1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.61
LMNA P02545 1/20 0.61
L3MBTL1 Q9Y468 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
NPC1 O15118 1/20 0.53

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 0.91 GAA (0.76) GAALMNAL3MBTL1TDP1NPC1
SCHEMBL18879750 0.82 IDO1 (0.43) GAALMNATDP1
SCHEMBL16270511 0.82 GAA (0.59) GAALMNAL3MBTL1TDP1NPC1
SCHEMBL7068289 0.82 LMNA (0.59) GAALMNAL3MBTL1TDP1NPC1
SCHEMBL197602 0.82 PTGS2 (0.58) GAALMNAL3MBTL1
SCHEMBL472034 0.81 ALOX15 (0.65) GAALMNAL3MBTL1TDP1NPC1
SCHEMBL689763 0.80 KMT2A (0.54) GAALMNATDP1
SCHEMBL689206 0.80 KMT2A (0.65) GAALMNATDP1
SCHEMBL13266603 0.79 KMT2A (0.40) GAALMNATDP1
SCHEMBL8068275 0.79 LMNA (0.44) GAALMNA

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-5286881-A Reacting substituted hydroxy benzofuranone with acetonitrile compound in presence of acid catalyst, oxidizing SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1994-02-15 US disclosed