SCHEMBL29630638

SCHEMBL29630638

CC[C@H](C)[C@H](NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 13/20 0.59
▸ MME P08473 9/20 0.59
▸ CPA1 P15085 6/20 0.59
▸ ACE2 Q9BYF1 6/20 0.59
▸ FOLH1 Q04609 1/20 0.46
▸ ANPEP P15144 1/20 0.46
▸ AGTR1 P30556 1/20 0.46
▸ LNPEP Q9UIQ6 1/20 0.46
▸ NTSR2 O95665 1/20 0.45
▸ NTSR1 P30989 1/20 0.45

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
SCHEMBL25626025 0.92 ACE (0.60) ACEMMECPA1ACE2ANPEP
SCHEMBL30416809 0.86 ACE (0.53) ACEMMECPA1ACE2FOLH1
SCHEMBL30051541 0.86 ACE (0.64) ACEMMECPA1ACE2
SCHEMBL29644411 0.85 MME (0.52) ACEMMECPA1ACE2FOLH1
SCHEMBL25626030 0.84 ACE (0.63) ACEMMECPA1ACE2
SCHEMBL25626301 0.84 ACE (0.63) ACEMMECPA1ACE2
SCHEMBL29472195 0.84 F2 (0.52) NTSR2NTSR1
SCHEMBL30139031 0.84 ACE (0.56) ACEMMECPA1ACE2ANPEP
SCHEMBL30895730 0.84 ACE (0.65) ACEMMECPA1ACE2FOLH1
SCHEMBL15692291 0.84 ACE (0.65) ACEMMECPA1ACE2FOLH1

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
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