SCHEMBL7068281

SCHEMBL7068281

O=C(c1ccccc1)c1c(-c2ccccc2)oc2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.67
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.56
LMNA P02545 2/20 0.56
MAPT P10636 2/20 0.56
GAA P10253 2/20 0.56
ALDH1A1 P00352 1/20 0.56
HTT P42858 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
KDM4E B2RXH2 2/20 0.54
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
TP53 P04637 1/20 0.54
ABCB1 P08183 1/20 0.54
CYP3A4 P08684 1/20 0.54
CALM1 P0DP23 1/20 0.54
AR P10275 1/20 0.54
PKM P14618 1/20 0.54
ALOX15 P16050 1/20 0.54

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
SCHEMBL11672355 0.91 L3MBTL1 (0.64) L3MBTL1KMT2AMEN1LMNAGAA
SCHEMBL11734608 0.91 L3MBTL1 (0.64) L3MBTL1KMT2AMEN1LMNAMAPT
SCHEMBL27784285 0.89 KMT2A (0.63) L3MBTL1KMT2AMEN1LMNAMAPT
SCHEMBL11673639 0.87 CYP2C19 (0.67) L3MBTL1KMT2AMEN1LMNAMAPT
SCHEMBL5579331 0.86 KDM4E (0.57) L3MBTL1KMT2AMEN1LMNAMAPT
SCHEMBL11735500 0.85 L3MBTL1 (0.92) L3MBTL1CNR2NPC1BCHECNR1
SCHEMBL11673920 0.85 L3MBTL1 (0.92) L3MBTL1CNR2NPC1BCHECNR1
SCHEMBL11732285 0.83 L3MBTL1 (0.55) L3MBTL1KMT2AMEN1LMNAMAPT
SCHEMBL31314572 0.83 RAB9A (0.70) L3MBTL1KMT2AMEN1LMNAMAPT
SCHEMBL11181979 0.82 CYP2C19 (0.67) L3MBTL1KMT2AMEN1LMNAMAPT

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-0731098-B1 Alpha-substituted-3-benzyl-benzofurans LILLY CO ELI (US) 2003-06-18 EP disclosed