SCHEMBL8620524

SCHEMBL8620524

CCCCC(=NOC)C(=O)Oc1ccccc1COc1cccc(C(F)(F)F)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 4/20 0.48
MCL1 Q07820 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
FAAH O00519 2/20 0.41
MRGPRX4 Q96LA9 1/20 0.40
MAOB P27338 1/20 0.39
PTGES O14684 2/20 0.39
ALOX5 P09917 2/20 0.39
PPARG P37231 2/20 0.39
PPARA Q07869 1/20 0.39
PSEN1 P49768 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
BRD4 O60885 1/20 0.39

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
SCHEMBL8620517 0.91 HIF1A (0.51) HIF1AMCL1L3MBTL1MRGPRX4MAOB
SCHEMBL8620586 0.86 FFAR1 (0.42) HIF1AL3MBTL1
SCHEMBL8622766 0.84 HIF1A (0.52) HIF1AMCL1L3MBTL1MRGPRX4MAOB
SCHEMBL8623899 0.79 TDP1 (0.39) ALDH1A1
SCHEMBL8623949 0.77 PTGDR2 (0.41) L3MBTL1PPARGPPARAALDH1A1HTT
SCHEMBL8618263 0.76 ANO1 (0.46) HIF1AMRGPRX4ALDH1A1
SCHEMBL8619527 0.75 HIF1A (0.45) HIF1AL3MBTL1MAOB
SCHEMBL8618334 0.72 HIF1A (0.67) HIF1AMCL1L3MBTL1MRGPRX4MAOB
SCHEMBL8618337 0.72 HIF1A (0.67) HIF1AMCL1L3MBTL1MRGPRX4MAOB
SCHEMBL8617320 0.71 HIF1A (0.66) HIF1AMCL1L3MBTL1MRGPRX4MAOB

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-0658541-B1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO (JP) 1998-05-20 EP disclosed
US-5510506-A Process for producing carboxylic acid derivatives SHIONOGI & CO., LTD. (JP) 1996-04-23 US disclosed
EP-0658541-A1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO., LTD. (JP) 1995-06-21 EP disclosed