SCHEMBL11211657

SCHEMBL11211657

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

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
ALOX15 P16050 1/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
DPP4 P27487 1/20 0.32
DPP8 Q6V1X1 1/20 0.32
DPP9 Q86TI2 1/20 0.32
NOS1 P29475 2/20 0.30
NOS3 P29474 1/20 0.30
NOS2 P35228 1/20 0.30
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL28501210 1.00 KMT2A (0.40) KMT2AALOX15BLMPMP22DPP4
SCHEMBL8764441 0.89 KMT2A (0.39) KMT2AALOX15BLMPMP22MEN1
SCHEMBL1692053 0.84 ALOX15 (0.52) KMT2AALOX15BLMPMP22DPP4
SCHEMBL1692048 0.84 ALOX15 (0.52) KMT2AALOX15BLMPMP22DPP4
SCHEMBL27916807 0.83 KMT2A (0.35) KMT2AALOX15BLMPMP22MEN1
SCHEMBL16862530 0.83 GSR (0.38) KMT2AMEN1GAA
SCHEMBL16862531 0.83 GSR (0.38) KMT2AMEN1GAA
SCHEMBL4032761 0.80 ALOX15 (0.44) KMT2AALOX15BLMPMP22DPP4
SCHEMBL156958 0.80 ALOX15 (0.47) KMT2AALOX15BLMPMP22DPP4
SCHEMBL30360527 0.80 ALOX15 (0.52) KMT2AALOX15BLMPMP22DPP4

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
EP-0006068-B1 COMPOUNDS OF THE MURAMYL-PEPTIDE TYPE AND MEDICINES CONTAINING THEM ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1983-09-21 EP disclosed