SCHEMBL16498057

SCHEMBL16498057

Cn1c(=O)oc2cc(-c3ccccc3-c3csc(N(C(=O)[C@@H](CC(=O)O)CC4CCCC4)C4CC4)n3)cnc21

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 11/20 0.68
KDM1A O60341 1/20 0.33
SLC12A5 Q9H2X9 3/20 0.33
HRH3 Q9Y5N1 1/20 0.31
USP19 O94966 2/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP12 P39900 1/20 0.30

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
SCHEMBL16498058 1.00 FFAR2 (0.68) FFAR2KDM1ASLC12A5HRH3USP19
SCHEMBL16498008 0.90 FFAR2 (0.67) FFAR2KDM1ASLC12A5HRH3
SCHEMBL16498007 0.90 FFAR2 (0.67) FFAR2KDM1ASLC12A5HRH3
SCHEMBL1916394 0.88 FFAR2 (0.70) FFAR2SLC12A5
SCHEMBL1916398 0.88 FFAR2 (0.70) FFAR2SLC12A5
SCHEMBL1917095 0.88 FFAR2 (0.69) FFAR2SLC12A5USP19MMP2MMP9
SCHEMBL1917089 0.88 FFAR2 (0.69) FFAR2SLC12A5USP19MMP2MMP9
SCHEMBL16498102 0.88 FFAR2 (0.71) FFAR2KDM1ASLC12A5MMP2MMP9
SCHEMBL16498965 0.88 FFAR2 (0.71) FFAR2KDM1ASLC12A5MMP2MMP9
SCHEMBL1915893 0.88 FFAR2 (0.71) FFAR2SLC12A5USP19MMP2MMP9

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
WO-2011151434-A1 NOVEL COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-12-08 WO claimed
WO-2011151434-A1 NOVEL COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-12-08 WO disclosed