SCHEMBL10657930

SCHEMBL10657930

CCCCC(=O)NC(COC)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 10/20 0.55
LPAR3 Q9UBY5 4/20 0.45
SLC6A5 Q9Y345 1/20 0.45
MEN1 O00255 1/20 0.44
FAAH O00519 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 1/20 0.44
ITGB3 P05106 1/20 0.44
ITGA2B P08514 1/20 0.44
LPAR1 Q92633 2/20 0.44
ALDH1A1 P00352 1/20 0.43
GLP1R P43220 1/20 0.42

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
SCHEMBL10657934 1.00 NOD1 (0.55) NOD1LPAR3SLC6A5MEN1FAAH
SCHEMBL5529716 0.84 PSMB5 (0.44) NOD1LPAR3
SCHEMBL4627107 0.82 NOD1 (0.62) NOD1SLC6A5MEN1FAAHMAPK1
SCHEMBL9652260 0.80 NOD1 (0.60) NOD1SLC6A5MEN1FAAHMAPK1
SCHEMBL9831556 0.80 NOD1 (0.75) NOD1SLC6A5
SCHEMBL9831553 0.80 NOD1 (0.75) NOD1SLC6A5
SCHEMBL31720996 0.80 NOD1 (0.60) NOD1SLC6A5MEN1FAAHMAPK1
SCHEMBL10064044 0.80 DNM1 (0.51) LPAR3MEN1FAAHMAPK1KMT2A
SCHEMBL9829528 0.80 NOD1 (0.70) NOD1SLC6A5MEN1FAAHMAPK1
SCHEMBL9829527 0.80 NOD1 (0.70) NOD1SLC6A5MEN1FAAHMAPK1

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
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed