SCHEMBL1915975

SCHEMBL1915975

O=C(O)C[C@@H](CC1CCCC1)C(=O)N(c1nc(-c2ccccc2-c2ccc(N3CCCCC3=O)nc2)cs1)C1CC1

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 11/20 0.74
CNR2 P34972 1/20 0.37
USP19 O94966 1/20 0.32
SLC12A5 Q9H2X9 2/20 0.32
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP12 P39900 1/20 0.31
CPT2 P23786 1/20 0.31
CPT1A P50416 1/20 0.31
ITGB3 P05106 1/20 0.31
ITGA2B P08514 1/20 0.31
KDM1A O60341 1/20 0.31

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
SCHEMBL1915979 1.00 FFAR2 (0.74) FFAR2CNR2USP19SLC12A5MMP2
SCHEMBL1917149 0.98 FFAR2 (0.75) FFAR2CNR2USP19SLC12A5MMP2
SCHEMBL1916204 0.98 FFAR2 (0.75) FFAR2CNR2USP19SLC12A5MMP2
SCHEMBL16498011 0.96 FFAR2 (0.73) FFAR2CNR2USP19SLC12A5ITGB3
SCHEMBL16498009 0.96 FFAR2 (0.73) FFAR2CNR2USP19SLC12A5ITGB3
SCHEMBL1917141 0.95 FFAR2 (0.67) FFAR2CNR2SLC12A5
SCHEMBL1917136 0.95 FFAR2 (0.67) FFAR2CNR2SLC12A5
SCHEMBL1916323 0.92 FFAR2 (0.67) FFAR2CNR2USP19SLC12A5
SCHEMBL2397473 0.92 FFAR2 (0.67) FFAR2CNR2USP19SLC12A5
SCHEMBL1916167 0.92 FFAR2 (0.63) FFAR2CNR2USP19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2364297-A1 Compounds, pharmaceutical composition and methods for use in treating metabolic disorders Euroscreen S.A. (BE) 2011-09-14 EP claimed
WO-2011076734-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING INFLAMMATORY DISEASES EUROSCREEN S.A. (BE) 2011-06-30 WO claimed
WO-2011076732-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING GASTROINTESTINAL DISORDERS EUROSCREEN S.A. (BE) 2011-06-30 WO claimed
WO-2010066682-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2010-06-17 WO claimed