SCHEMBL6150433

SCHEMBL6150433

COC=C(C(=O)O)c1ccccc1COc1cc(Cl)c(OC(F)(F)C(F)OC(F)(F)F)c(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 4/20 0.33
MRGPRX4 Q96LA9 4/20 0.33
TP53 P04637 1/20 0.33
HTT P42858 1/20 0.33
SCN9A Q15858 1/20 0.32
NPC1 O15118 1/20 0.32
NR4A2 P43354 1/20 0.32
RAB9A P51151 1/20 0.32
BCL2 P10415 1/20 0.32
MCL1 Q07820 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
SCHEMBL6150429 1.00 HIF1A (0.33) HIF1AMRGPRX4TP53HTTSCN9A
SCHEMBL5074499 0.92 HIF1A (0.38) HIF1AMRGPRX4SCN9A
SCHEMBL6149505 0.92 TP53 (0.36) HIF1AMRGPRX4TP53HTTNPC1
SCHEMBL6149508 0.92 TP53 (0.36) HIF1AMRGPRX4TP53HTTNPC1
SCHEMBL5079624 0.89 MRGPRX4 (0.39) HIF1AMRGPRX4TP53HTTSCN9A
SCHEMBL5079611 0.89 MRGPRX4 (0.39) HIF1AMRGPRX4TP53HTTSCN9A
SCHEMBL5074501 0.85 HIF1A (0.35) HIF1AMRGPRX4TP53HTTSCN9A
SCHEMBL5074500 0.85 TP53 (0.35) HIF1AMRGPRX4TP53HTTSCN9A
SCHEMBL5074553 0.84 HIF1A (0.39) HIF1AMRGPRX4TP53HTTSCN9A
SCHEMBL5076937 0.82 HIF1A (0.37) HIF1AMRGPRX4TP53HTTSCN9A

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