SCHEMBL6149505

SCHEMBL6149505

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

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36
MRGPRX4 Q96LA9 5/20 0.36
NR4A2 P43354 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
HIF1A Q16665 3/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 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
SCHEMBL6149508 1.00 TP53 (0.36) TP53HTTMRGPRX4NR4A2NPC1
SCHEMBL6150429 0.92 HIF1A (0.33) TP53HTTMRGPRX4NR4A2NPC1
SCHEMBL6150433 0.92 HIF1A (0.33) TP53HTTMRGPRX4NR4A2NPC1
SCHEMBL5074553 0.91 HIF1A (0.39) TP53HTTMRGPRX4HIF1A
SCHEMBL5079611 0.91 MRGPRX4 (0.39) TP53HTTMRGPRX4NR4A2NPC1
SCHEMBL5079624 0.91 MRGPRX4 (0.39) TP53HTTMRGPRX4NR4A2NPC1
SCHEMBL5077012 0.86 MRGPRX4 (0.38) TP53HTTMRGPRX4NR4A2NPC1
SCHEMBL5077003 0.86 MRGPRX4 (0.38) TP53HTTMRGPRX4NR4A2NPC1
SCHEMBL5074510 0.86 HIF1A (0.38) MRGPRX4HIF1A
SCHEMBL5079484 0.86 MRGPRX4 (0.44) TP53HTTMRGPRX4NR4A2NPC1

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