SCHEMBL27930488

SCHEMBL27930488

CCOCC(N)(C(=O)O)C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.34

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
SCHEMBL3428450 0.81 DGAT1 (0.41) DGAT1
SCHEMBL27850761 0.81 DGAT1 (0.41) DGAT1
SCHEMBL3286466 0.81 DGAT1 (0.39) DGAT1
SCHEMBL1422856 0.81 DGAT1 (0.39) DGAT1
SCHEMBL27807040 0.80 L3MBTL1 (0.34) DGAT1
SCHEMBL27807043 0.80 L3MBTL1 (0.34) DGAT1
SCHEMBL6372947 0.78 DGAT1 (0.36) DGAT1
SCHEMBL28721112 0.77 DGAT1 (0.39) DGAT1
SCHEMBL4366519 0.77 DGAT1 (0.39) DGAT1
SCHEMBL609386 0.77 DGAT1 (0.39) 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
CN-103476767-A Heterocyclic compounds as PI3 kinase inhibitors HOFFMANN LA ROCHE 2013-12-25 CN disclosed