SCHEMBL9570784

SCHEMBL9570784

CCOc1ccc(C(COCc2ccc(F)c(Oc3ccc(OC(F)(F)F)cc3)c2)C(F)(F)F)cc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.37
HCRTR1 O43613 13/20 0.36
HCRTR2 O43614 13/20 0.36
CACNA1C Q13936 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
ATM Q13315 1/20 0.36
FFAR1 O14842 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.34
PDE2A O00408 1/20 0.33
CASR P41180 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
SCHEMBL9570783 0.92 CACNA1C (0.42) L3MBTL1CACNA1CLMNAMAPTATM
SCHEMBL9862416 0.91 MAPT (0.40) L3MBTL1CACNA1CLMNAMAPTATM
SCHEMBL9570596 0.91 CACNA1C (0.37) L3MBTL1CACNA1CLMNAMAPTATM
SCHEMBL409992 0.91 LTA4H (0.41) L3MBTL1CACNA1CLMNAMAPTATM
SCHEMBL9570736 0.91 CACNA1C (0.37) L3MBTL1CACNA1CLMNAMAPTATM
SCHEMBL9560849 0.91 MAPT (0.40) L3MBTL1CACNA1CLMNAMAPTATM
SCHEMBL9570581 0.90 MAPT (0.46) L3MBTL1CACNA1CLMNAMAPTATM
SCHEMBL9561457 0.90 CACNA1C (0.36) L3MBTL1CACNA1CLMNAMAPTATM
SCHEMBL9570657 0.89 CACNA1C (0.36) L3MBTL1HCRTR1HCRTR2CACNA1CLMNA
SCHEMBL9560528 0.89 CETP (0.40) CACNA1CMRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0545891-A2 Aldehyde compounds and derivatives thereof useful as intermediates in the preparation of insectical ether compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-06-09 EP disclosed
US-4840971-A INSECTICIDES, MITICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-06-20 US disclosed
EP-0240978-A2 Ether compounds, process for their preparation, compositions containing the same and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-14 EP disclosed