SCHEMBL8772880

SCHEMBL8772880

COC=C(C(=O)OC)c1ccccc1CON=C(C)c1noc2cc(OCc3cccc(C(F)(F)F)c3)ccc12

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.44
MAPT P10636 2/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAOB P27338 5/20 0.41
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
CYP19A1 P11511 1/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
POLB P06746 1/20 0.37
ANO1 Q5XXA6 1/20 0.37

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
SCHEMBL9057229 1.00 HIF1A (0.44) HIF1AMAPTHTTL3MBTL1MAOB
SCHEMBL8772917 0.93 HIF1A (0.42) HIF1AMAOBPPARGPPARDPPARA
SCHEMBL9055753 0.93 HIF1A (0.42) HIF1AMAOBPPARGPPARDPPARA
SCHEMBL8772695 0.89 MAOB (0.39) HIF1AMAOB
SCHEMBL9057286 0.89 MAOB (0.39) HIF1AMAOB
SCHEMBL9056334 0.85 HIF1A (0.37) HIF1AMAPTHTTPOLB
SCHEMBL9056404 0.84 HIF1A (0.35) HIF1AMAOB
SCHEMBL9056410 0.84 HIF1A (0.35) HIF1AMAOB
SCHEMBL9055635 0.84 NR1H4 (0.36) HIF1AMAPTMAOB
SCHEMBL9055642 0.84 NR1H4 (0.36) HIF1AMAPTMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0789692-A1 BENZISOXAZOLE DERIVATIVES AND PESTICIDAL COMPOSITIONS CONTAINING THEM Novartis AG (CH) 1997-08-20 EP claimed
WO-1996014305-A1 BENZISOXAZOLE DERIVATIVES AND PESTICIDAL COMPOSITIONS CONTAINING THEM NOVARTIS AG (CH) 1996-05-17 WO claimed
EP-0789692-A1 BENZISOXAZOLE DERIVATIVES AND PESTICIDAL COMPOSITIONS CONTAINING THEM Novartis AG (CH) 1997-08-20 EP disclosed
WO-1996014305-A1 BENZISOXAZOLE DERIVATIVES AND PESTICIDAL COMPOSITIONS CONTAINING THEM NOVARTIS AG (CH) 1996-05-17 WO disclosed