SCHEMBL2587771

SCHEMBL2587771

CCCOC(=O)C(N)CCCC=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 3/20 0.39
TSHR P16473 2/20 0.39
MAPT P10636 1/20 0.38
SLC15A1 P46059 1/20 0.38
HCAR2 Q8TDS4 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
FAAH O00519 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
LMNA P02545 1/20 0.33
ATM Q13315 1/20 0.32
P2RY10 O00398 1/20 0.32

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
SCHEMBL1300124 0.86 MAPT (0.47) NOD1TSHRMAPTSLC15A1DPP7
SCHEMBL27869324 0.80 DPP7 (0.44) NOD1SLC15A1DPP7
SCHEMBL31718803 0.80 NOD1 (0.51) NOD1MAPTDPP7
SCHEMBL19547634 0.80 DPP7 (0.44) NOD1SLC15A1DPP7
SCHEMBL1301293 0.80 MAPT (0.37) TSHRMAPTSLC15A1DPP7P2RY10
SCHEMBL7985007 0.79 CA2 (0.49) TSHRMAPTHCAR2ALDH1A1TRPV1
SCHEMBL453102 0.79 SLC1A2 (0.41) NOD1TSHRHCAR2DPP7ALDH1A1
SCHEMBL1096747 0.79 SLC1A2 (0.41) NOD1TSHRHCAR2DPP7ALDH1A1
SCHEMBL5670259 0.79 GSR (0.52) NOD1DPP7
SCHEMBL6432150 0.79 GSR (0.52) NOD1DPP7

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
EP-2563926-A1 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF PROPYLENE Genomatica, Inc. (US) 2013-03-06 EP disclosed
WO-2011137198-A1 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF PROPYLENE GENOMATICA, INC. (US) 2011-11-03 WO disclosed