SCHEMBL9664232

SCHEMBL9664232

CCCCCCCCCCCCCC(=O)N[C@@H](CC(N)=O)C(=O)OC(=O)[C@@H](N)CC(N)=O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 12/20 0.49
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
FAAH O00519 1/20 0.45
MAPK1 P28482 1/20 0.45
DNM1 Q05193 1/20 0.44
LPAR3 Q9UBY5 2/20 0.40
SLC6A5 Q9Y345 2/20 0.40

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
SCHEMBL2495617 0.93 KMT2A (0.51) NOD1KMT2AMEN1FAAHMAPK1
SCHEMBL24095932 0.83 KMT2A (0.58) NOD1KMT2AMEN1FAAHMAPK1
Asparagine SCHEMBL9664240 0.81 NOD1 (0.65) NOD1KMT2AMEN1FAAHMAPK1
Asparagine SCHEMBL9664230 0.81 NOD1 (0.65) NOD1KMT2AMEN1FAAHMAPK1
SCHEMBL7752876 0.80 NOD1 (0.55) NOD1KMT2AMEN1FAAHMAPK1
SCHEMBL7756180 0.80 NOD1 (0.55) NOD1KMT2AMEN1FAAHMAPK1
SCHEMBL9664089 0.80 FAAH (0.56) NOD1KMT2AMEN1FAAHMAPK1
SCHEMBL9664172 0.80 FAAH (0.56) NOD1KMT2AMEN1FAAHMAPK1
SCHEMBL21732833 0.80 FAAH (0.56) NOD1KMT2AMEN1FAAHMAPK1
SCHEMBL3062723 0.80 FAAH (0.56) NOD1KMT2AMEN1FAAHMAPK1

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-0473700-A1 AN ENZYME-CATALYZED PROCESS FOR PREPARING N-ACYL AMINO ACIDS AND N-ACYL AMINO ACID AMIDES NOVO NORDISK A/S (DK) 1992-03-11 EP claimed
WO-1990014429-A1 AN ENZYME-CATALYZED PROCESS FOR PREPARING N-ACYL AMINO ACIDS AND N-ACYL AMINO ACID AMIDES NOVO NORDISK A/S (DK) 1990-11-29 WO claimed