SCHEMBL7916170

SCHEMBL7916170

O=C(O)C(=Cc1ccc(F)cc1)OC(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 2/20 0.54
POLB P06746 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.44
PKM P14618 1/20 0.44
PTGS2 P35354 2/20 0.43
SNCA P37840 1/20 0.43
AKR1C1 Q04828 2/20 0.42
AKR1C2 P52895 1/20 0.40
AKR1C3 P42330 1/20 0.40
F2 P00734 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39

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
SCHEMBL7916168 0.94 MEN1 (0.50) PLA2G7POLBKMT2AMEN1NPC1
SCHEMBL7916275 0.88 PLA2G7 (0.51) PLA2G7POLBKMT2AMEN1NPC1
SCHEMBL7916266 0.82 RAB9A (0.47) PLA2G7POLBKMT2AMEN1NPC1
SCHEMBL775621 0.77 NPC1 (0.61) PLA2G7POLBKMT2AMEN1NPC1
SCHEMBL28275837 0.75 ALDH1A1 (0.46) PLA2G7POLBKMT2AMEN1NPC1
SCHEMBL6551351 0.74 AKR1C1 (0.52) PLA2G7POLBKMT2AMEN1ALDH1A1
SCHEMBL18050292 0.73 NPC1 (0.56) PLA2G7POLBKMT2AMEN1NPC1
Acetic Acid SCHEMBL777114 0.73 RAB9A (0.56) PLA2G7POLBKMT2AMEN1NPC1
SCHEMBL18050294 0.73 NPC1 (0.56) PLA2G7POLBKMT2AMEN1NPC1
SCHEMBL7913686 0.72 KMT2A (0.54) PLA2G7POLBKMT2AMEN1NPC1

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
US-6218501-B1 N-HYDROXYHYDROCARBYL-SUBSTITUTED MALEIMIDE POLYMER OR POLYIMIDE ESTERIFIED WITH CINNAMIC ACID DERIVATIVE CHEIL INDUSTRIES INC. (KR) 2001-04-17 US disclosed
US-6174649-B1 THERMOSTABILITY AND PHOTOELECTRIC CHARACTERISTICS SAMSUNG DISPLAY DEVICES CO., LTD. (KR) 2001-01-16 US disclosed