SCHEMBL29630564

SCHEMBL29630564

C[C@H](NC(=O)CN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC15A2 Q16348 1/20 0.43
MMP2 P08253 1/20 0.33
MMP7 P09237 1/20 0.33
MMP9 P14780 1/20 0.33
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
CPB2 Q96IY4 3/20 0.33
ACE P12821 3/20 0.33
CPB1 P15086 1/20 0.33
REN P00797 1/20 0.32
MME P08473 1/20 0.32
CPA1 P15085 1/20 0.32
ACE2 Q9BYF1 1/20 0.32
ECE1 P42892 1/20 0.32

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
SCHEMBL29429284 0.98 SLC15A2 (0.40) SLC15A2MMP2MMP7MMP9MMP12
SCHEMBL29590377 0.94 SLC15A2 (0.40) SLC15A2MMEECE1
SCHEMBL29590566 0.92 SLC15A2 (0.49) SLC15A2CPB2CPB1MME
SCHEMBL20783813 0.92 SLC15A2 (0.49) SLC15A2CPB2CPB1MME
SCHEMBL31453803 0.92 SLC15A2 (0.49) SLC15A2CPB2CPB1MME
SCHEMBL29591894 0.92 SLC15A2 (0.41) SLC15A2
SCHEMBL29626709 0.90 ACE (0.44) ACEMMECPA1ACE2
SCHEMBL29591786 0.90 SLC15A2 (0.41) SLC15A2
SCHEMBL31443168 0.88 CTSD (0.40) SLC15A2REN
SCHEMBL29630538 0.88 OPRD1 (0.38) SLC15A2

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