SCHEMBL30901123

SCHEMBL30901123

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AGTR2 P50052 2/20 0.53
▸ AGTR1 P30556 1/20 0.53
▸ C5AR1 P21730 1/20 0.51
▸ NTSR1 P30989 6/20 0.49
▸ NTSR2 O95665 3/20 0.49
▸ APLNR P35414 1/20 0.49
▸ EPHA2 P29317 2/20 0.48
▸ MC4R P32245 1/20 0.48
▸ F2 P00734 4/20 0.48
▸ SORT1 Q99523 2/20 0.47
▸ CTSL P07711 2/20 0.47
▸ CTSS P25774 2/20 0.47
▸ CTSK P43235 2/20 0.47
▸ CTSH P09668 1/20 0.47

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
SCHEMBL30901125 0.90 AGTR2 (0.47) AGTR2AGTR1C5AR1NTSR1NTSR2
SCHEMBL29701256 0.90 AGTR2 (0.65) AGTR2AGTR1C5AR1NTSR1NTSR2
SCHEMBL29701258 0.90 AGTR2 (0.55) AGTR2AGTR1C5AR1NTSR1NTSR2
Talfirastide SCHEMBL15926158 0.90 AGTR1 (0.59) AGTR2AGTR1C5AR1NTSR1NTSR2
SCHEMBL7052378 0.89 AGTR2 (0.65) AGTR2AGTR1C5AR1NTSR1NTSR2
SCHEMBL29972916 0.88 AGTR1 (0.62) AGTR2AGTR1C5AR1NTSR1NTSR2
Angiotensin Ii SCHEMBL9013950 0.88 AGTR2 (0.69) AGTR2AGTR1C5AR1NTSR1NTSR2
Angiotensin Ii SCHEMBL22125774 0.88 AGTR2 (0.69) AGTR2AGTR1C5AR1NTSR1NTSR2
Angiotensin Ii SCHEMBL29757879 0.88 AGTR2 (0.69) AGTR2AGTR1C5AR1NTSR1NTSR2
Angiotensin Ii SCHEMBL9013957 0.88 AGTR2 (0.69) AGTR2AGTR1C5AR1NTSR1NTSR2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4371556-A1 ANGIOTENSIN(1-7) PHARMACEUTICAL COMPOSITIONS FOR INHALATION Explicat Pharma GmbH (DE) 2024-05-22 — — EP disclosed
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