SCHEMBL8527151

SCHEMBL8527151

CNC(=O)C(=NOC)c1ccccc1COc1ccc(C2c3ccccc3CC2C)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.44
KCNH2 Q12809 2/20 0.36
TSHR P16473 2/20 0.32
PRMT5 O14744 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
SCN3A Q9NY46 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.30
EDNRB P24530 1/20 0.30
EDNRA P25101 1/20 0.30

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
SCHEMBL8539263 1.00 HIF1A (0.44) HIF1AKCNH2TSHRPRMT5CD274
SCHEMBL8528118 0.84 HIF1A (0.46) HIF1AKCNH2
SCHEMBL8527006 0.83 HIF1A (0.46) HIF1AKCNH2SCN3ACTDSP1
SCHEMBL8529479 0.82 MAPK1 (0.47) HIF1AKCNH2
SCHEMBL8369854 0.79 HIF1A (0.63) HIF1ATSHR
SCHEMBL8399406 0.79 HIF1A (0.63) HIF1ATSHR
SCHEMBL8369852 0.79 HIF1A (0.63) HIF1ATSHR
SCHEMBL8096251 0.78 HIF1A (0.56) HIF1A
SCHEMBL8096246 0.78 HIF1A (0.56) HIF1A
SCHEMBL8369944 0.78 HIF1A (0.56) HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0877730-A1 ARYL ACRYLICS FOR USE AS FUNGICIDE MONSANTO COMPANY (US) 1998-11-18 EP disclosed
US-5739140-A AGRICULTURAL FUNGICIDES MONSANTO COMPANY (US) 1998-04-14 US disclosed
WO-1997016413-A9 ARYL ACRYLICS FOR USE AS FUNGICIDE 1997-08-14 WO disclosed
WO-1997016413-A1 ARYL ACRYLICS FOR USE AS FUNGICIDE MONSANTO COMPANY (US) 1997-05-09 WO disclosed