SCHEMBL6150438

SCHEMBL6150438

CO/N=C(/C(=O)O)c1ccccc1COc1cc(Cl)c(OC(F)(F)C(F)C(F)(F)F)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.46
TP53 P04637 1/20 0.35
HTT P42858 1/20 0.35
MRGPRX4 Q96LA9 6/20 0.35
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
NPC1 O15118 1/20 0.33
NR4A2 P43354 1/20 0.33
RAB9A P51151 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
SCHEMBL6150442 1.00 HIF1A (0.46) HIF1ATP53HTTMRGPRX4ALDH1A1
SCHEMBL6150541 0.94 HIF1A (0.48) HIF1ATP53HTTMRGPRX4NPC1
SCHEMBL6150542 0.94 HIF1A (0.48) HIF1ATP53HTTMRGPRX4NPC1
SCHEMBL5076429 0.92 HIF1A (0.38) HIF1ATP53HTTMRGPRX4ALDH1A1
SCHEMBL5074563 0.90 HIF1A (0.46) HIF1ATP53HTTMRGPRX4
SCHEMBL5074559 0.90 HIF1A (0.46) HIF1ATP53HTTMRGPRX4
SCHEMBL5079449 0.89 HIF1A (0.50) HIF1ATP53HTTMRGPRX4NPC1
SCHEMBL5079440 0.89 HIF1A (0.50) HIF1ATP53HTTMRGPRX4NPC1
SCHEMBL5075953 0.86 HIF1A (0.58) HIF1ATP53HTTMRGPRX4
SCHEMBL5075954 0.86 HIF1A (0.39) HIF1ATP53HTTMRGPRX4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1494991-A1 ANALOGOUS COMPOUNDS OF STROBILURINES AND THEIR USE AS ACARICIDES AND INSECTICIDES Isagro Ricerca S.r.l. (IT) 2005-01-12 EP disclosed
WO-2003087032-A1 ANALOGOUS COMPOUNDS OF STROBILURINES AND THEIR USE AS ACARICIDES AND INSECTICIDES ISAGRO RICERCA S.R.L. (IT) 2003-10-23 WO disclosed