SCHEMBL3089100

SCHEMBL3089100

COC(=O)Oc1cc(Br)c(C(F)(F)Cl)[nH]c1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CUL4A Q13619 2/20 0.38
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
NOTUM Q6P988 1/20 0.31
KDM4E B2RXH2 2/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PIM1 P11309 1/20 0.31
JAK2 O60674 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B1 P14061 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
SCHEMBL4665653 0.89 CUL4A (0.39) CUL4AGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL16372098 0.85 CUL4A (0.39) CUL4AKDM4EHPGDHSD17B10JAK2
SCHEMBL4906582 0.78 SOS1 (0.44) NOTUMKDM4EALDH1A1GAAMAPT
SCHEMBL16372082 0.76 HSD17B2 (0.47) CUL4ANOTUMKDM4EHPGDHSD17B10
SCHEMBL16612698 0.76 CUL4A (0.40) CUL4AGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4667450 0.73 HSD17B2 (0.38) CUL4AKDM4EHPGDHSD17B10JAK2
SCHEMBL16372027 0.72 HSD17B1 (0.33) KDM4EHPGDHSD17B10HSD17B1HSD17B2
SCHEMBL16371315 0.69 DAO (0.30)
SCHEMBL16612938 0.69 HSD17B2 (0.37) CUL4AKDM4EHPGDHSD17B10JAK2
SCHEMBL3088157 0.67 HSD17B2 (0.48) HSD17B1HSD17B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2144879-B1 PYRIDON CARBOXAMIDES, AGENTS CONTAINING THESE BUT NOT IMPACTING USEFUL PLANTS AND METHOD FOR THEIR MANUFACTURE AND APPLICATION BAYER IP GMBH (DE) 2015-04-08 EP disclosed
EP-2144879-A2 PYRIDONECARBOXAMIDES CROP PROTECTION AGENTS CONTAINING THE SAME METHOD FOR PRODUCTION AND USE THEREOF Bayer CropScience AG (DE) 2010-01-20 EP disclosed
WO-2008131860-A2 PYRIDONECARBOXAMIDES CROP PROTECTION AGENTS CONTAINING THE SAME METHOD FOR PRODUCTION AND USE THEREOF BAYER CROPSCIENCE AG (DE) 2008-11-06 WO disclosed