SCHEMBL8624147

SCHEMBL8624147

CCCCCCCCCCCC(=O)n1cnc(CC(NC(=O)CCN)C(=O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 9/20 0.52
ITGB3 P05106 2/20 0.50
ITGA2B P08514 2/20 0.50
CPB1 P15086 3/20 0.47
FAAH O00519 2/20 0.45
NOD1 Q9Y239 4/20 0.44
SLC6A5 Q9Y345 2/20 0.43

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
SCHEMBL408085 1.00 CPB2 (0.52) CPB2ITGB3ITGA2BCPB1FAAH
SCHEMBL5964511 1.00 CPB2 (0.52) CPB2ITGB3ITGA2BCPB1FAAH
SCHEMBL21372487 1.00 CPB2 (0.52) CPB2ITGB3ITGA2BCPB1FAAH
SCHEMBL8625496 1.00 CPB2 (0.52) CPB2ITGB3ITGA2BCPB1FAAH
SCHEMBL8621283 1.00 CPB2 (0.52) CPB2ITGB3ITGA2BCPB1FAAH
SCHEMBL8989234 1.00 CPB2 (0.52) CPB2ITGB3ITGA2BCPB1FAAH
SCHEMBL5964669 0.99 CPB2 (0.53) CPB2ITGB3ITGA2BCPB1FAAH
SCHEMBL5964745 0.96 CPB2 (0.51) CPB2ITGB3ITGA2BCPB1FAAH
SCHEMBL8625507 0.94 SLC6A5 (0.53) CPB2ITGB3ITGA2BCPB1FAAH
SCHEMBL6937530 0.92 CPB2 (0.44) CPB2ITGB3ITGA2BCPB1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0500332-B1 Novel acylamino acid compounds and a method for their production NAT FOOD RESEARCH INST MINISTR (JP) 1998-05-27 EP disclosed
US-5503776-A PROTECTIVE COATINGS, EMULSIFIERS, BACTERICIDES, ULTRAVIOLET ABSORBERS, CHELATING NATIONAL FOOD RESEARCH INSTITUTE MINISTRY OF AGRICULTURE, FORESTRY AND FISHERIES (JP) 1996-04-02 US disclosed
EP-0500332-A2 Novel acylamino acid compounds and a method for their production NATIONAL FOOD RESEARCH INSTITUTE MINISTRY OF AGRICULTURE, FORESTRY AND FISHERIES (JP) 1992-08-26 EP disclosed