SCHEMBL3928136

SCHEMBL3928136

O=C(Nc1ccccc1)c1nnc(Nc2ccc(F)c(F)c2)o1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 20/20 0.69
SOAT1 P35610 6/20 0.65
DGAT2 Q96PD7 1/20 0.55
ACAT1 P24752 1/20 0.55

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
SCHEMBL3548447 0.91 DGAT1 (0.83) DGAT1SOAT1DGAT2
SCHEMBL5249259 0.89 DGAT1 (0.60) DGAT1SOAT1
SCHEMBL3471197 0.88 DGAT1 (0.65) DGAT1SOAT1
SCHEMBL5254069 0.87 DGAT1 (0.58) DGAT1SOAT1
SCHEMBL15638678 0.86 DGAT1 (0.57) DGAT1SOAT1DGAT2ACAT1
SCHEMBL4788842 0.86 DGAT1 (0.62) DGAT1SOAT1
SCHEMBL4787021 0.86 DGAT1 (0.65) DGAT1SOAT1
SCHEMBL5302124 0.85 DGAT1 (0.71) DGAT1SOAT1
SCHEMBL5306081 0.85 DGAT1 (0.67) DGAT1SOAT1
SCHEMBL3545111 0.84 DGAT1 (0.68) DGAT1SOAT1DGAT2

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
WO-2008129319-A1 SALTS OF OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2008-10-30 WO claimed
EP-2041101-A1 CRYSTALLINE FORM OF (TRANS-4- [ ( { 5- [ (3, 4 -DI FLUOROPHENYL) AMINO]-1,3, 4-OXADIAZOL-2-YL}CARBONYL) AMINO]PH ENYL } CYCLOHEXYL) ACETIC ACID AstraZeneca AB (SE) 2009-04-01 EP disclosed
WO-2008129319-A1 SALTS OF OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2008-10-30 WO disclosed
WO-2007144571-A1 CRYSTALLINE FORM OF (TRANS-4- [ ( { 5- [ (3, 4 -DI FLUOROPHENYL) AMINO] -1,3, 4-OXADIAZOL-2-YL}CARBONYL) AMINO] PH ENYL } CYCLOHEXYL) ACETIC ACID ASTRAZENECA AB (SE) 2007-12-21 WO disclosed