SCHEMBL901694

SCHEMBL901694

CS(=O)(=O)c1ccc2[nH]c(-c3ccc(-c4ccc(C5CCC(CC(=O)O)CC5)cc4)c(F)c3)nc2c1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 14/20 0.52
SOAT1 P35610 2/20 0.52
SCD O00767 1/20 0.46
FADS1 O60427 1/20 0.46
KCNH2 Q12809 2/20 0.43
ADORA2A P29274 1/20 0.42

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
SCHEMBL10188929 0.93 DGAT1 (0.52) DGAT1SOAT1SCDFADS1KCNH2
SCHEMBL10189113 0.90 DGAT1 (0.64) DGAT1SOAT1SCD
SCHEMBL10189571 0.81 DGAT1 (0.40) DGAT1SOAT1SCDFADS1KCNH2
SCHEMBL10189564 0.81 DGAT1 (0.47) DGAT1SOAT1KCNH2
SCHEMBL10189649 0.80 DGAT1 (0.52) DGAT1SOAT1SCD
SCHEMBL10189215 0.78 DGAT1 (0.49) DGAT1SOAT1SCD
SCHEMBL10381835 0.78 DGAT1 (0.59) DGAT1KCNH2ADORA2A
SCHEMBL902157 0.77 DGAT1 (0.75) DGAT1SOAT1SCDKCNH2ADORA2A
SCHEMBL902462 0.77 DGAT1 (0.73) DGAT1SOAT1KCNH2ADORA2A
SCHEMBL902394 0.77 DGAT1 (0.65) DGAT1SOAT1SCDKCNH2ADORA2A

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-2012044567-A2 IMIDAZOLE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2012-04-05 WO disclosed