SCHEMBL6150765

SCHEMBL6150765

CO/N=C(/C(=O)O)c1ccccc1CCOc1cc(Cl)c(OC(F)(F)F)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 7/20 0.40
RORC P51449 1/20 0.36
PDK2 Q15119 4/20 0.35
SIRT2 Q8IXJ6 2/20 0.35
TRPV1 Q8NER1 1/20 0.34
FFAR4 Q5NUL3 2/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
FFAR1 O14842 1/20 0.33
CYP2C9 P11712 1/20 0.33
SCN5A Q14524 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
SCHEMBL6150770 1.00 HIF1A (0.40) HIF1ARORCPDK2SIRT2TRPV1
SCHEMBL5079449 0.90 HIF1A (0.50) HIF1AMRGPRX4
SCHEMBL5079440 0.90 HIF1A (0.50) HIF1AMRGPRX4
SCHEMBL6150671 0.85 HIF1A (0.52) HIF1A
SCHEMBL6150664 0.85 HIF1A (0.52) HIF1A
SCHEMBL6150541 0.82 HIF1A (0.48) HIF1AMRGPRX4
SCHEMBL6150542 0.82 HIF1A (0.48) HIF1AMRGPRX4
SCHEMBL6150442 0.80 HIF1A (0.46) HIF1AMRGPRX4
SCHEMBL6150438 0.80 HIF1A (0.46) HIF1AMRGPRX4
SCHEMBL5079444 0.80 HIF1A (0.49) HIF1APDK2MRGPRX4

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