SCHEMBL8444517

SCHEMBL8444517

CO/N=C(C)/C(C)=N/OCc1ccccc1/C(=N\OC)C(=O)OC

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.60
PTGS2 P35354 1/20 0.41
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
KDM4E B2RXH2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 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
SCHEMBL8444521 1.00 HIF1A (0.60) HIF1APTGS2ALDH1A1LMNAKDM4E
SCHEMBL8163429 0.94 HIF1A (0.57) HIF1APTGS2ALDH1A1LMNAKDM4E
SCHEMBL13054270 0.91 HIF1A (0.61) HIF1APTGS2ALDH1A1LMNAPKM
SCHEMBL13148667 0.87 HIF1A (0.46) HIF1APTGS2ALDH1A1LMNAHPGD
SCHEMBL6557968 0.87 HIF1A (0.53) HIF1APTGS2ALDH1A1LMNAKDM4E
SCHEMBL8447501 0.87 HIF1A (0.46) HIF1APTGS2ALDH1A1LMNAKDM4E
SCHEMBL8447507 0.87 HIF1A (0.46) HIF1APTGS2ALDH1A1LMNAKDM4E
SCHEMBL23972091 0.86 HIF1A (0.67) HIF1ALMNAHPGDKMT2AHTT
SCHEMBL7558159 0.86 HIF1A (0.67) HIF1ALMNAPKMHPGDKMT2A
SCHEMBL25603257 0.86 HIF1A (0.58) HIF1APTGS2ALDH1A1LMNAHPGD

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-0893433-A1 ALPHA-ALKOXYIMINOBENZYL DERIVATIVES AND AGRICULTURAL CHEMICALS CONTAINING THEM AS ACTIVE INGREDIENTS SHIONOGI & CO., LTD. (JP) 1999-01-27 EP disclosed