SCHEMBL11032201

SCHEMBL11032201

CSCC[C@@H](N)C(=O)NC(C)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
SLC15A1 P46059 1/20 0.41
CTSC P53634 2/20 0.39
RNPEP Q9H4A4 1/20 0.38
METAP2 P50579 1/20 0.38
METAP1 P53582 1/20 0.38
ANPEP P15144 1/20 0.36
ENPEP Q07075 1/20 0.36
FNTA P49354 2/20 0.35
FNTB P49356 2/20 0.35
PGGT1B P53609 1/20 0.35
ARG1 P05089 1/20 0.35
ARG2 P78540 1/20 0.35
NOS2 P35228 2/20 0.34
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
TSHR P16473 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
BHMT Q93088 1/20 0.33
BHMT2 Q9H2M3 1/20 0.33

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
SCHEMBL2342224 1.00 ALDH1A1 (0.41) ALDH1A1SLC15A1CTSCRNPEPMETAP2
SCHEMBL2342221 1.00 ALDH1A1 (0.41) ALDH1A1SLC15A1CTSCRNPEPMETAP2
SCHEMBL17746783 0.90 SLC15A1 (0.48) ALDH1A1SLC15A1CTSCRNPEPMETAP2
SCHEMBL26092196 0.86 SLC15A1 (0.42) SLC15A1CTSCRNPEPMETAP2METAP1
SCHEMBL538814 0.85 SLC15A1 (0.41) SLC15A1CTSCRNPEPMETAP2METAP1
SCHEMBL538813 0.85 SLC15A1 (0.41) SLC15A1CTSCRNPEPMETAP2METAP1
SCHEMBL11113223 0.84 CRBN (0.39) ALDH1A1SLC15A1ANPEPNOS2NOS3
SCHEMBL11112208 0.84 CRBN (0.39) ALDH1A1SLC15A1ANPEPNOS2NOS3
SCHEMBL7766597 0.81 METAP2 (0.39) SLC15A1CTSCRNPEPMETAP2METAP1
SCHEMBL7765918 0.81 METAP2 (0.39) SLC15A1CTSCRNPEPMETAP2METAP1

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-59044354-A None JP disclosed
JP-S5944354-A RACEMIZATION OF OPTICALLY ACTIVE N-ACETYL-METHIONINAMIDE TANABE SEIYAKU CO LTD 1984-03-12 JP disclosed