SCHEMBL29630361

SCHEMBL29630361

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

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 5/20 0.54
▸ ACE P12821 5/20 0.53
▸ CPA1 P15085 1/20 0.53
▸ ACE2 Q9BYF1 1/20 0.53
▸ SLC7A5 Q01650 1/20 0.53
▸ FOLH1 Q04609 1/20 0.51
▸ NAALAD2 Q9Y3Q0 1/20 0.51
▸ NPY1R P25929 1/20 0.51
▸ NPY2R P49146 1/20 0.51
▸ NPY4R P50391 1/20 0.51
▸ ENPEP Q07075 2/20 0.50
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ OPRM1 P35372 1/20 0.48
▸ OPRD1 P41143 1/20 0.48

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
SCHEMBL30122989 1.00 MME (0.54) MMEACECPA1ACE2SLC7A5
SCHEMBL30839491 0.99 MME (0.53) MMEACECPA1ACE2SLC7A5
SCHEMBL2228574 0.96 MME (0.58) MMEACECPA1ACE2SLC7A5
SCHEMBL10715137 0.96 MME (0.58) MMEACECPA1ACE2SLC7A5
SCHEMBL31031588 0.95 SLC7A5 (0.56) MMEACECPA1ACE2SLC7A5
SCHEMBL29619568 0.95 ENPEP (0.56) MMEACECPA1ACE2SLC7A5
SCHEMBL30123104 0.95 ENPEP (0.56) MMEACECPA1ACE2SLC7A5
SCHEMBL30974501 0.94 ENPEP (0.53) MMEACECPA1ACE2SLC7A5
SCHEMBL30390719 0.91 MME (0.55) MMEACECPA1ACE2SLC7A5
SCHEMBL29430160 0.91 ENPEP (0.55) MMEACECPA1ACE2SLC7A5

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
Send feedback