SCHEMBL11668477

SCHEMBL11668477

CC(CO)NC(=O)[C@@H](N)CC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.41
DPP8 Q6V1X1 2/20 0.41
DPP9 Q86TI2 2/20 0.41
MME P08473 2/20 0.40
BHMT Q93088 1/20 0.35
CNR1 P21554 4/20 0.35
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35
PDCD1LG2 Q9BQ51 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
SCN9A Q15858 2/20 0.34

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
SCHEMBL5053928 1.00 DPP4 (0.41) DPP4DPP8DPP9MMEBHMT
SCHEMBL27183221 0.83 SLC7A5 (0.45) DPP4DPP8DPP9MMESCN9A
SCHEMBL24270547 0.82 DPP4 (0.44) DPP4DPP8DPP9MMEBHMT
SCHEMBL10801006 0.82 DPP4 (0.44) DPP4DPP8DPP9MMEBHMT
SCHEMBL27182806 0.81 DPP9 (0.42) DPP4DPP8DPP9BHMTS1PR1
SCHEMBL11789649 0.81 PAX8 (0.41) DPP4DPP8DPP9MMEBHMT
SCHEMBL2742759 0.81 DPP4 (0.54) DPP4DPP8DPP9
SCHEMBL27182875 0.81 DPP4 (0.42) DPP4DPP8DPP9MMEBHMT
SCHEMBL12118145 0.81 DPP4 (0.54) DPP4DPP8DPP9
SCHEMBL27183123 0.80 DPP4 (0.38) DPP4DPP8DPP9BHMTS1PR1

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
JP-52091822-A None JP disclosed
JP-S5291822-A FATTY ACID ESTERS OF 2-N-ASPARTYLAMINO-ALKANOL TANABE SEIYAKU CO LTD 1977-08-02 JP disclosed