SCHEMBL8505441

SCHEMBL8505441

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

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 5/20 0.41
L3MBTL1 Q9Y468 2/20 0.34
MAPT P10636 1/20 0.34
KCNA5 P22460 1/20 0.34
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NR1H4 Q96RI1 1/20 0.33

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
SCHEMBL8502333 1.00 HIF1A (0.41) HIF1AL3MBTL1MAPTKCNA5CA2
SCHEMBL8503709 0.87 HIF1A (0.45) HIF1AL3MBTL1MAPTKCNA5ALDH1A1
SCHEMBL8502166 0.82 HIF1A (0.38) HIF1AL3MBTL1MAPTKCNA5ALDH1A1
SCHEMBL8502165 0.82 HIF1A (0.38) HIF1AL3MBTL1MAPTKCNA5ALDH1A1
SCHEMBL7690938 0.82 HIF1A (0.34) HIF1AL3MBTL1MAPTALDH1A1TSHR
SCHEMBL8504258 0.79 HIF1A (0.39) HIF1AL3MBTL1MAPTKCNA5ALDH1A1
SCHEMBL8502676 0.78 HIF1A (0.39) HIF1ACA2CA9
SCHEMBL9895311 0.78 HIF1A (0.48) HIF1AL3MBTL1
SCHEMBL9895318 0.78 HIF1A (0.48) HIF1AL3MBTL1
SCHEMBL9895313 0.78 HIF1A (0.48) HIF1AL3MBTL1

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
US-5990161-A PESTICIDES, FUNGICIDES AND INSECTICIDES FOR KILLING ANTHROPODS; PLANT PROTECTION; CROPS; CONTROLLING RHONE-POULENC AGROCHIMIE (FR) 1999-11-23 US disclosed
EP-0821667-A1 NEW HYDROXIMIC ACID DERIVATIVES RHONE-POULENC AGROCHIMIE (FR) 1998-02-04 EP disclosed
WO-1996033164-A1 NEW HYDROXIMIC ACID DERIVATIVES RHONE-POULENC AGROCHIMIE (FR) 1996-10-24 WO disclosed