SCHEMBL7779845

SCHEMBL7779845

CON=C(C(N)=O)c1ccccc1COc1ccccc1C

nearest known ligand 0.78

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.50
MAPT P10636 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
RXRA P19793 1/20 0.45
RXRB P28702 1/20 0.45
RXRG P48443 1/20 0.45
PARP1 P09874 1/20 0.44
AKR1C1 Q04828 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TP53 P04637 1/20 0.42
HTT P42858 1/20 0.42
RECQL P46063 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL8205297 1.00 HIF1A (0.50) HIF1AMAPTTDP1RXRARXRB
SCHEMBL435569 0.89 HIF1A (0.51) HIF1AMAPTTDP1RXRARXRB
SCHEMBL435570 0.89 HIF1A (0.51) HIF1AMAPTTDP1RXRARXRB
SCHEMBL6899784 0.89 HIF1A (0.51) HIF1AMAPTTDP1RXRARXRB
SCHEMBL8781729 0.89 HIF1A (0.50) HIF1AMAPTTDP1RXRARXRB
SCHEMBL7541196 0.88 HIF1A (0.49) HIF1AMAPTPARP1AKR1C1MEN1
SCHEMBL7962502 0.88 HIF1A (0.52) HIF1APARP1AKR1C1
SCHEMBL2839948 0.88 HIF1A (0.49) HIF1AMAPTPARP1AKR1C1MEN1
SCHEMBL2839951 0.88 HIF1A (0.49) HIF1AMAPTPARP1AKR1C1MEN1
Kresoxym-Methyl SCHEMBL12920836 0.88 HIF1A (0.64) HIF1AMAPTTDP1RXRARXRB

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-0840721-B1 CARBOXYLIC ACID AMIDE DERIVATIVES AND THEIR USE AS PESTICIDES BAYER AG (DE) 2001-10-04 EP disclosed
US-6114342-A 2-(O-[pyrimidin-4-yl]methylenoxy)phenylacetic acid derivatives and their use for controlling harmful fungi and animal pests BASF AKTIENGESELLSCHAFT (DE) 2000-09-05 US disclosed
EP-0840721-A1 CARBOXYLIC ACID AMIDE DERIVATIVES AND THEIR USE AS PESTICIDES BAYER AG (DE) 1998-05-13 EP disclosed
WO-1997000856-A1 CARBOXYLIC ACID AMIDE DERIVATIVES AND THEIR USE AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-01-09 WO disclosed