SCHEMBL30445948

SCHEMBL30445948

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

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 5/20 0.61
▸ NPY1R P25929 3/20 0.61
▸ NPY2R P49146 3/20 0.61
▸ FOLH1 Q04609 1/20 0.56
▸ MME P08473 6/20 0.53
▸ ACE P12821 3/20 0.53
▸ OPRM1 P35372 3/20 0.52
▸ OPRD1 P41143 3/20 0.52
▸ NPY5R Q15761 2/20 0.50
▸ CPA1 P15085 1/20 0.49
▸ ACE2 Q9BYF1 1/20 0.49
▸ OPRK1 P41145 1/20 0.49

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
SCHEMBL30473752 0.97 NPY4R (0.62) NPY4RNPY1RNPY2RFOLH1MME
SCHEMBL30957419 0.90 MME (0.55) NPY4RNPY1RNPY2RMMEACE
SCHEMBL31257061 0.88 NPY4R (0.66) NPY4RNPY1RNPY2RFOLH1MME
SCHEMBL30578468 0.87 FOLH1 (0.62) NPY4RNPY1RNPY2RFOLH1ACE
SCHEMBL31614428 0.87 FOLH1 (0.62) NPY4RNPY1RNPY2RFOLH1ACE
SCHEMBL29379597 0.87 FOLH1 (0.62) NPY4RNPY1RNPY2RFOLH1MME
SCHEMBL30473791 0.87 FOLH1 (0.65) NPY4RNPY1RNPY2RFOLH1MME
SCHEMBL30249020 0.87 NPY4R (0.59) NPY4RNPY1RNPY2RFOLH1MME
SCHEMBL29845347 0.87 OPRD1 (0.63) NPY4RNPY1RNPY2RFOLH1ACE
SCHEMBL29721184 0.86 NPY4R (0.58) NPY4RNPY1RNPY2RFOLH1MME

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-4192843-A1 PEPTIDES ABLE TO BIND ANGIOTENSIN-CONVERTING ENZYME 2 (ACE2) AND MEDICAL USES THEREOF Ospedale Pediatrico Bambino Gesù (IT) 2023-06-14 — — EP claimed
EP-4192843-A1 PEPTIDES ABLE TO BIND ANGIOTENSIN-CONVERTING ENZYME 2 (ACE2) AND MEDICAL USES THEREOF Ospedale Pediatrico Bambino Gesù (IT) 2023-06-14 — — EP disclosed
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