SCHEMBL9015765

SCHEMBL9015765

CO/N=C(/C(=O)NOC)c1ccccc1COc1ccccc1C

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.49
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
SGMS2 Q8NHU3 1/20 0.40
PARP1 P09874 1/20 0.40
AKR1C1 Q04828 1/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.39
NPSR1 Q6W5P4 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
SCHEMBL8883792 1.00 HIF1A (0.49) HIF1AMAPTTDP1SGMS2PARP1
SCHEMBL7221376 0.89 HIF1A (0.50) HIF1AMAPTTDP1SGMS2RXRA
SCHEMBL8368495 0.89 HIF1A (0.50) HIF1AMAPTTDP1SGMS2RXRA
SCHEMBL7969954 0.89 HIF1A (0.50) HIF1AMAPTTDP1SGMS2RXRA
SCHEMBL7072974 0.89 HIF1A (0.50) HIF1AMAPTTDP1SGMS2RXRA
SCHEMBL7662127 0.88 HIF1A (0.45) HIF1AMAPTTDP1SGMS2PARP1
SCHEMBL8395405 0.87 HIF1A (0.48) HIF1AMAPTTDP1SGMS2RXRA
SCHEMBL8395411 0.87 HIF1A (0.48) HIF1AMAPTTDP1SGMS2RXRA
SCHEMBL8624081 0.87 HIF1A (0.48) HIF1AMAPTTDP1SGMS2RXRA
Kresoxym-Methyl SCHEMBL12920836 0.87 HIF1A (0.64) HIF1AMAPTTDP1SGMS2RXRA

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
US-5523454-A FUNGICIDES, PESTICIDES BASF AKTIENGESELLSCHAFT (DE) 1996-06-04 US disclosed