SCHEMBL8329343

SCHEMBL8329343

O=C(O)Cc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.60
EPHX2 P34913 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.59
MAPK14 Q16539 1/20 0.57
RXRA P19793 5/20 0.57
RXRB P28702 5/20 0.57
RXRG P48443 5/20 0.57
SRD5A2 P31213 2/20 0.57
PSEN1 P49768 1/20 0.56
PSEN2 P49810 1/20 0.56
APH1B Q8WW43 1/20 0.56
NCSTN Q92542 1/20 0.56
APH1A Q96BI3 1/20 0.56
PSENEN Q9NZ42 1/20 0.56
THRB P10828 3/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
PPARD Q03181 2/20 0.52
PPARA Q07869 2/20 0.52
THRA P10827 1/20 0.52

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
SCHEMBL267205 0.89 RXRA (0.68) RXRARXRBRXRGSRD5A2PSEN1
Water SCHEMBL28015733 0.87 RXRA (0.66) RXRARXRBRXRGSRD5A2PSEN1
Hydrochloric Acid SCHEMBL2528774 0.87 RXRA (0.66) RXRARXRBRXRGSRD5A2PSEN1
SCHEMBL3498978 0.85 MAOB (0.67) RXRARXRBRXRGPPARDPPARA
SCHEMBL21243832 0.85 SRD5A2 (0.72) SRD5A2THRBTHRAFFAR1NR3C1
SCHEMBL2999416 0.85 SRD5A2 (0.72) SRD5A2THRBTHRAFFAR1NR3C1
SCHEMBL9155110 0.85 LTA4H (0.56) LTA4HEPHX2MAPK14MEN1KMT2A
SCHEMBL9266226 0.85 LTA4H (0.56) LTA4HEPHX2SMN1; SMN2MAPK14MEN1
SCHEMBL11077637 0.85 THRB (0.60) LTA4HEPHX2SMN1; SMN2MAPK14RXRA
SCHEMBL2272003 0.84 RXRA (0.77) RXRARXRBRXRGPSEN1PSEN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4485114-A Arylglyoxals useful as hypoglycemic agents AMERICAN CYANAMID COMPANY (US) 1984-11-27 US claimed
EP-0556381-B1 N-(4-PYRIDYL OR 4-QUINOLINYL) ARYLACETAMIDE PESTICIDES DOW AGROSCIENCES LLC (US) 1999-04-28 EP disclosed
US-5597836-A NEMATOCIDES, INSECTICIDES, MITICIDES AND PLANT PATHOGENS DOWELANCO (US) 1997-01-28 US disclosed
EP-0555469-A4 4-(ARALKOXY OR ARALKYLAMINO)PYRIDINE PESTICIDES----------------- DOWELANCO (US) 1995-06-21 EP disclosed
EP-0556381-A4 DOWELANCO (US) 1995-06-21 EP disclosed
US-5399564-A N-(4-pyridyl or 4-quinolinyl) arylacetamide and 4-(aralkoxy or aralkylamino) pyridine pesticides DOWELANCO (US) 1995-03-21 US disclosed
EP-0556381-A1 N-(4-PYRIDYL OR 4-QUINOLINYL) ARYLACETAMIDE PESTICIDES DOWELANCO (US) 1993-08-25 EP disclosed
EP-0555469-A1 4-(ARALKOXY OR ARALKYLAMINO)PYRIDINE PESTICIDES----------------- DOWELANCO (US) 1993-08-18 EP disclosed
WO-1993005050-A1 4-(ARALKOXY OR ARALKYLAMINO)PYRIDINE PESTICIDES_________________ DOWELANCO (US) 1993-03-18 WO disclosed
WO-1993004580-A1 N-(4-PYRIDYL OR 4-QUINOLINYL) ARYLACETAMIDE PESTICIDES DOWELANCO (US) 1993-03-18 WO disclosed
US-4485114-A Arylglyoxals useful as hypoglycemic agents AMERICAN CYANAMID COMPANY (US) 1984-11-27 US disclosed