SCHEMBL8834965

SCHEMBL8834965

CC=CC(=O)OCCCOc1ccc2c(C)cc(=O)oc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.58
MAOA P21397 3/20 0.58
KMT2A Q03164 4/20 0.56
MEN1 O00255 2/20 0.56
RAB9A P51151 2/20 0.56
AR P10275 2/20 0.56
KDM4E B2RXH2 7/20 0.54
ALDH1A1 P00352 7/20 0.54
MAPT P10636 2/20 0.54
HPGD P15428 2/20 0.54
HSD17B10 Q99714 2/20 0.54
TP53 P04637 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.53
GLA P06280 4/20 0.53
GAA P10253 4/20 0.53
TSHR P16473 1/20 0.53
ALDH2 P05091 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
POLB P06746 1/20 0.53
ACHE P22303 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
SCHEMBL8835418 0.98 MAOB (0.60) MAOBMAOAKMT2AMEN1RAB9A
SCHEMBL8835021 0.94 KMT2A (0.60) MAOBMAOAKMT2AMEN1RAB9A
SCHEMBL28919905 0.88 MAOB (0.60) MAOBMAOAKMT2AMEN1RAB9A
SCHEMBL8834993 0.87 KDM4E (0.59) MAOBMAOAKMT2AMEN1RAB9A
SCHEMBL7920347 0.85 MAOB (0.61) MAOBMAOAKMT2AMEN1RAB9A
SCHEMBL28598939 0.84 MAOB (0.60) MAOBMAOAKMT2AMEN1RAB9A
SCHEMBL8834751 0.83 MAOA (0.56) MAOBMAOAKMT2AMEN1RAB9A
SCHEMBL8834945 0.82 KDM4E (0.57) MAOBMAOAKMT2AMEN1RAB9A
SCHEMBL8834803 0.82 AGER (0.59) MAOBKMT2AMEN1ARKDM4E
SCHEMBL30837680 0.82 KMT2A (0.61) MAOBMAOAKMT2AMEN1RAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783537-A1 CUMARIN AND QUINOLINONE DERIVATIVES FOR PREPARING LIQUID CRYSTAL ORIENTATION LAYERS F. HOFFMANN-LA ROCHE AG (CH) 1997-07-16 EP disclosed
WO-1996010049-A1 CUMARIN AND QUINOLINONE DERIVATIVES FOR PREPARING LIQUID CRYSTAL ORIENTATION LAYERS F. HOFFMANN-LA ROCHE AG (CH) 1996-04-04 WO disclosed