SCHEMBL8697284

SCHEMBL8697284

CC(=NO)c1cccc(OCc2cccc(Cl)c2)c1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.73
MAOA P21397 4/20 0.73
NR4A2 P43354 2/20 0.67
RXRA P19793 2/20 0.53
RXRB P28702 2/20 0.53
RXRG P48443 2/20 0.53
NPC1 O15118 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
RAB9A P51151 1/20 0.51
PKM P14618 1/20 0.51
F2 P00734 1/20 0.50

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
SCHEMBL8694329 0.84 MAOB (1.00) MAOBMAOANR4A2RXRARXRB
SCHEMBL13802461 0.80 NR4A2 (1.00) MAOBMAOANR4A2RXRARXRB
SCHEMBL9586301 0.80 NR4A2 (0.74) MAOBMAOANR4A2RXRARXRB
SCHEMBL29784229 0.80 NR4A2 (1.00) MAOBMAOANR4A2RXRARXRB
SCHEMBL9587641 0.80 MAOB (0.76) MAOBMAOANR4A2RXRARXRB
SCHEMBL15452539 0.79 NR4A2 (0.77) MAOBMAOANR4A2RXRARXRB
SCHEMBL9586293 0.79 NR4A2 (0.77) MAOBMAOANR4A2RXRARXRB
SCHEMBL3144886 0.78 HTT (0.62) CYP1A2CYP2D6
SCHEMBL3144887 0.78 HTT (0.62) CYP1A2CYP2D6
SCHEMBL16795661 0.78 NR4A2 (0.67) MAOBMAOANR4A2RXRARXRB

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
WO-1998017631-A2 SUBSTITUTED OXIME-ETHERS AND THEIR USE AS PESTICIDES NOVARTIS AG (CH) 1998-04-30 WO disclosed