SCHEMBL16612698

SCHEMBL16612698

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

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CUL4A Q13619 2/20 0.40
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
KDM4E B2RXH2 3/20 0.33
HSD17B10 Q99714 2/20 0.33
HPGD P15428 1/20 0.33
ALDH1A1 P00352 2/20 0.32
JAK2 O60674 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LCK P06239 1/20 0.32
FYN P06241 1/20 0.32

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
SCHEMBL3086593 0.85 LCK (0.30) LCKFYN
SCHEMBL4665653 0.78 CUL4A (0.39) CUL4AGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4907153 0.78 KDM4E (0.44) KDM4EALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL3089100 0.76 CUL4A (0.38) CUL4AGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3092091 0.71 HSD17B2 (0.40) CUL4AKDM4EHSD17B10HPGDALDH1A1
SCHEMBL3084659 0.71 BRD4 (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL12804666 0.69 ALDH1A1 (0.44) KDM4EHSD17B10HPGDALDH1A1GAA
SCHEMBL3087985 0.69 HPGD (0.42) KDM4EHSD17B10HPGDALDH1A1MAPT
SCHEMBL16372082 0.68 HSD17B2 (0.47) CUL4AKDM4EHSD17B10HPGDALDH1A1
SCHEMBL16372098 0.66 CUL4A (0.39) CUL4AKDM4EHSD17B10HPGDALDH1A1

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
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