SCHEMBL6538428

SCHEMBL6538428

CC(C)COC(=O)C(NC(=O)C1=NOC(C(O)(C(F)(F)F)C(F)(F)F)C1)C(C)C

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 20/20 0.62

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
SCHEMBL648037 0.87 MLYCD (0.69) MLYCD
SCHEMBL1895701 0.84 MLYCD (0.64) MLYCD
SCHEMBL6730506 0.78 MLYCD (0.65) MLYCD
SCHEMBL647139 0.74 MLYCD (1.00) MLYCD
SCHEMBL647138 0.70 MLYCD (0.70) MLYCD
SCHEMBL647659 0.68 MLYCD (1.00) MLYCD
SCHEMBL650108 0.64 MLYCD (0.58) MLYCD
SCHEMBL12868401 0.62 MLYCD (0.51) MLYCD
SCHEMBL16658566 0.61 CTSK (0.54)
SCHEMBL1515310 0.61 CTSK (0.54)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2004527475-A 2004-09-09 JP claimed
EP-1411929-A2 MALONYL-COA DECARBOXYLASE INHIBITORS USEFUL AS METABOLIC MODULATORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2004-04-28 EP claimed
WO-2002058698-A2 MALONYL-COA DECARBOXYLASE INHIBITORS USEFUL AS METABOLIC MODULATORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-08-01 WO claimed