SCHEMBL29630637

SCHEMBL29630637

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

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.44
ACE P12821 1/20 0.44
CPA1 P15085 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
PDCD1LG2 Q9BQ51 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38
SLC7A5 Q01650 1/20 0.38
LTA4H P09960 3/20 0.37
SLC1A1 P43005 1/20 0.35

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
SCHEMBL29462560 1.00 MME (0.44) MMEACECPA1ACE2PDCD1LG2
SCHEMBL29531322 0.96 MME (0.47) MMEACECPA1ACE2PDCD1LG2
SCHEMBL30781147 0.96 MME (0.47) MMEACECPA1ACE2PDCD1LG2
SCHEMBL5841678 0.96 MME (0.47) MMEACECPA1ACE2PDCD1LG2
SCHEMBL5841680 0.96 MME (0.47) MMEACECPA1ACE2PDCD1LG2
SCHEMBL23030200 0.96 MME (0.47) MMEACECPA1ACE2PDCD1LG2
SCHEMBL30792485 0.87 PDCD1LG2 (0.42) MMEPDCD1LG2CD274LTA4H
SCHEMBL30552861 0.87 MME (0.41) MMEACECPA1ACE2PDCD1LG2
SCHEMBL29876890 0.87 MME (0.47) MMEACEPDCD1LG2CD274
SCHEMBL30552712 0.87 MME (0.47) MMEACEPDCD1LG2CD274

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
US-11807899-B2 Biochemical reaction methods and reagents comprising intrinsically disordered regions Biocrucible Limited 2023-11-07 US disclosed
US-20220145378-A1 BIOCHEMICAL REACTION METHODS AND REAGENTS COMPRISING INTRINSICALLY DISORDERED REGIONS Biocrucible Limited (GB) 2022-05-12 US disclosed