SCHEMBL14628590

SCHEMBL14628590

COc1ccc(CC(=O)c2ccc(CO)cc2OC)cc1OC

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.76
▸ SMN1; SMN2 Q16637 3/20 0.76
▸ HTT P42858 3/20 0.76
▸ MAPK1 P28482 1/20 0.66
▸ GAA P10253 3/20 0.62
▸ NPSR1 Q6W5P4 1/20 0.62
▸ NPC1 O15118 2/20 0.58
▸ KMT2A Q03164 3/20 0.57
▸ MEN1 O00255 2/20 0.57
▸ MAPT P10636 1/20 0.57
▸ HPGD P15428 1/20 0.57
▸ HSP90AA1 P07900 2/20 0.55
▸ HIF1A Q16665 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ ABL1 P00519 1/20 0.49
▸ RIN1 Q13671 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ LDHA P00338 1/20 0.49
▸ EPHX2 P34913 1/20 0.48
▸ CA2 P00918 1/20 0.47

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
SCHEMBL2538729 0.87 SMN1; SMN2 (1.00) LMNASMN1; SMN2HTTMAPK1GAA
SCHEMBL30511126 0.87 SMN1; SMN2 (0.74) LMNASMN1; SMN2HTTMAPK1GAA
SCHEMBL12233251 0.87 LMNA (0.74) LMNASMN1; SMN2HTTMAPK1GAA
SCHEMBL11761322 0.85 LMNA (0.79) LMNASMN1; SMN2HTTMAPK1GAA
SCHEMBL119395 0.82 CA2 (0.68) NPC1MAPTRAB9AALDH1A1LDHA
SCHEMBL28170408 0.82 CA2 (0.68) NPC1MAPTRAB9AALDH1A1LDHA
SCHEMBL29997296 0.82 CA2 (0.68) NPC1MAPTRAB9AALDH1A1LDHA
SCHEMBL19104759 0.81 HPGDS (0.53) LMNASMN1; SMN2HTTMAPK1GAA
SCHEMBL19104748 0.81 SMN1; SMN2 (0.51) LMNASMN1; SMN2HTTMAPK1GAA
SCHEMBL30511135 0.81 SMN1; SMN2 (0.78) LMNASMN1; SMN2HTTMAPK1GAA

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
EP-1743881-A1 Phenyl-benzyl-ketones G.J. Consultants Pty Ltd (AU) 2007-01-17 — — EP disclosed
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