SCHEMBL5300455

SCHEMBL5300455

Cc1cc(C)cc(Nc2nnc(C(=O)Nc3ccccc3)o2)c1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 19/20 0.58
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
SOAT1 P35610 2/20 0.46

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
SCHEMBL4788254 0.91 DGAT1 (0.62) DGAT1NPC1RAB9A
SCHEMBL5302124 0.85 DGAT1 (0.71) DGAT1NPC1RAB9ASOAT1
SCHEMBL5248671 0.81 DGAT1 (0.64) DGAT1NPC1RAB9A
SCHEMBL5302933 0.81 DGAT1 (0.57) DGAT1NPC1RAB9A
SCHEMBL4788842 0.81 DGAT1 (0.62) DGAT1NPC1RAB9ASOAT1
SCHEMBL3536787 0.81 DGAT1 (0.75) DGAT1NPC1RAB9A
SCHEMBL18236237 0.80 DGAT1 (0.55) DGAT1NPC1RAB9A
SCHEMBL4787021 0.80 DGAT1 (0.65) DGAT1SOAT1
SCHEMBL5307790 0.80 DGAT1 (0.61) DGAT1NPC1RAB9ASOAT1
SCHEMBL3928136 0.80 DGAT1 (0.69) DGAT1SOAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1833806-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS AstraZeneca AB (SE) 2007-09-19 EP disclosed
WO-2006064189-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2006-06-22 WO disclosed