SCHEMBL4788552

SCHEMBL4788552

O=C(Nc1ccccc1)c1nnc(Nc2c(F)cccc2F)o1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 19/20 0.67
KMT2A Q03164 1/20 0.49

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
SCHEMBL5252296 0.86 DGAT1 (0.73) DGAT1
SCHEMBL4788842 0.83 DGAT1 (0.62) DGAT1KMT2A
SCHEMBL4787021 0.83 DGAT1 (0.65) DGAT1KMT2A
SCHEMBL3928136 0.82 DGAT1 (0.69) DGAT1
SCHEMBL5306081 0.82 DGAT1 (0.67) DGAT1
SCHEMBL5302124 0.82 DGAT1 (0.71) DGAT1KMT2A
SCHEMBL4788135 0.80 DGAT1 (0.68) DGAT1
SCHEMBL4786731 0.80 DGAT1 (0.68) DGAT1
SCHEMBL3541491 0.80 DGAT1 (1.00) DGAT1
SCHEMBL3542383 0.80 DGAT1 (0.82) DGAT1

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 1 patent. 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 disclosed