SCHEMBL1897781

SCHEMBL1897781

O=C(O)c1ccc(CN(C(=O)c2ccncc2)c2ncc(C(O)(C(F)(F)F)C(F)(F)F)s2)cc1

nearest known ligand 0.86

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 20/20 0.86

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
SCHEMBL647994 0.93 MLYCD (1.00) MLYCD
SCHEMBL1897937 0.90 MLYCD (0.75) MLYCD
SCHEMBL1899914 0.88 MLYCD (0.80) MLYCD
SCHEMBL1899912 0.88 MLYCD (0.72) MLYCD
SCHEMBL6538355 0.87 MLYCD (1.00) MLYCD
SCHEMBL1907028 0.86 MLYCD (1.00) MLYCD
SCHEMBL1896899 0.83 MLYCD (0.82) MLYCD
SCHEMBL10044255 0.82 MLYCD (0.80) MLYCD
SCHEMBL1898629 0.79 MLYCD (1.00) MLYCD
SCHEMBL10044256 0.77 MLYCD (0.82) MLYCD

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
EP-1411929-B1 MALONYL-COA DECARBOXYLASE INHIBITORS USEFUL AS METABOLIC MODULATORS CHUGAI PHARMACEUTICAL CO LTD (JP) 2011-05-11 EP claimed