SCHEMBL29630389

SCHEMBL29630389

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

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 2/20 0.33
ACE P12821 1/20 0.33
SLC15A2 Q16348 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
SCHEMBL20397512 1.00 CTRB1 (0.33) CTRB1ACESLC15A2
SCHEMBL20397457 1.00 CTRB1 (0.33) CTRB1ACESLC15A2
SCHEMBL30035137 0.98 CTRB1 (0.34) CTRB1ACE
SCHEMBL29749371 0.95 MME (0.36) ACE
SCHEMBL29749372 0.95 MME (0.36) ACE
SCHEMBL31113634 0.95 CTRB1 (0.36) CTRB1ACESLC15A2
SCHEMBL29912552 0.93 ACE (0.39) ACE
SCHEMBL31259943 0.93 MME (0.37) ACE
SCHEMBL2549667 0.93 MME (0.37) ACE
SCHEMBL31259941 0.93 MME (0.37) ACE

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