SCHEMBL15565128

SCHEMBL15565128

CC1CCC(Oc2ccc3c(CN4CCCC(CC(=O)O)C4)cccc3c2C(F)(F)F)CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 10/20 0.46
S1PR5 Q9H228 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LTA4H P09960 2/20 0.37
FFAR1 O14842 1/20 0.37
KDM4E B2RXH2 2/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL16860077 1.00 ENPP2 (0.46) ENPP2S1PR5L3MBTL1ALDH1A1LMNA
SCHEMBL15600008 1.00 ENPP2 (0.46) ENPP2S1PR5L3MBTL1ALDH1A1LMNA
SCHEMBL16860089 0.92 ENPP2 (0.49) ENPP2S1PR5L3MBTL1ALDH1A1LMNA
SCHEMBL15565216 0.92 ENPP2 (0.49) ENPP2S1PR5L3MBTL1ALDH1A1LMNA
SCHEMBL15565749 0.92 ENPP2 (0.49) ENPP2S1PR5L3MBTL1ALDH1A1LMNA
SCHEMBL16860073 0.92 ENPP2 (0.43) ENPP2S1PR5L3MBTL1ALDH1A1LMNA
SCHEMBL15600013 0.92 ENPP2 (0.43) ENPP2S1PR5L3MBTL1ALDH1A1LMNA
SCHEMBL15565129 0.92 ENPP2 (0.43) ENPP2S1PR5L3MBTL1ALDH1A1LMNA
SCHEMBL16860094 0.87 ENPP2 (0.44) ENPP2S1PR5L3MBTL1ALDH1A1LMNA
SCHEMBL16860095 0.87 ENPP2 (0.44) ENPP2S1PR5L3MBTL1ALDH1A1LMNA

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-2879673-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS Biogen Idec MA Inc. (US) 2015-06-10 EP claimed
WO-2014025709-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS BIOGEN IDEC MA INC. (US) 2014-02-13 WO claimed
EP-2879673-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS Biogen Idec MA Inc. (US) 2015-06-10 EP disclosed
WO-2014025709-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS BIOGEN IDEC MA INC. (US) 2014-02-13 WO disclosed