SCHEMBL29626709

SCHEMBL29626709

C[C@H](NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.44
MME P08473 5/20 0.44
CPA1 P15085 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
OPRD1 P41143 5/20 0.42
OPRM1 P35372 4/20 0.42
OPRK1 P41145 1/20 0.42
FOLH1 Q04609 1/20 0.42

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
SCHEMBL29626745 0.91 MME (0.45) ACEMMECPA1ACE2OPRD1
SCHEMBL29630564 0.90 SLC15A2 (0.43) ACEMMECPA1ACE2
SCHEMBL29429284 0.88 SLC15A2 (0.40) ACEMMECPA1ACE2
SCHEMBL29590377 0.87 SLC15A2 (0.40) MME
SCHEMBL29615620 0.86 ACE (0.48) ACEMMECPA1ACE2OPRD1
SCHEMBL29894761 0.86 OPRD1 (0.42) ACEMMECPA1ACE2OPRD1
SCHEMBL29531471 0.85 ACE (0.47) ACEMMECPA1ACE2OPRD1
SCHEMBL5598789 0.84 MME (0.46) ACEMMECPA1ACE2
SCHEMBL5598794 0.84 MME (0.46) ACEMMECPA1ACE2
SCHEMBL30692732 0.84 MME (0.46) ACEMMECPA1ACE2

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
EP-3443096-B1 COMPOSITIONS AND METHODS FOR SELECTIVE EXPRESSION OF CHIMERIC ANTIGEN RECEPTORS NOVARTIS AG (CH) 2023-03-01 EP claimed
EP-4004213-A1 REGULATABLE EXPRESSION SYSTEMS Novartis AG (CH) 2022-06-01 EP claimed