SCHEMBL31721983

SCHEMBL31721983

C[C@@H](O)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 4/20 0.50
▸ ACE P12821 1/20 0.49
▸ MC4R P32245 1/20 0.49
▸ CRHR1 P34998 1/20 0.48
▸ CRHR2 Q13324 1/20 0.48
▸ AGTR1 P30556 1/20 0.48
▸ AGTR2 P50052 1/20 0.48
▸ CALCRL Q16602 1/20 0.48
▸ F2 P00734 4/20 0.47
▸ OPRK1 P41145 1/20 0.47
▸ C5AR1 P21730 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
SCHEMBL29530972 0.90 C5AR1 (0.45) CALCRACEMC4RCRHR1CRHR2
SCHEMBL29530685 0.87 CALCR (0.45) CALCRACECRHR1CRHR2CALCRL
SCHEMBL30974039 0.87 CALCR (0.55) CALCRMC4RCRHR1CRHR2F2
SCHEMBL30414513 0.86 CALCR (0.59) CALCRMC4RCRHR1CRHR2F2
SCHEMBL30565599 0.86 AGTR1 (0.59) CALCRAGTR1AGTR2
SCHEMBL30565596 0.86 AGTR1 (0.59) CALCRAGTR1AGTR2
SCHEMBL31130616 0.85 MC4R (0.57) CALCRMC4RCRHR1CRHR2F2
SCHEMBL29530818 0.85 CRHR1 (0.46) CALCRACEMC4RCRHR1CRHR2
SCHEMBL30565598 0.85 CALCR (0.57) CALCRAGTR1AGTR2
SCHEMBL30565601 0.85 CALCR (0.57) CALCRAGTR1AGTR2

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
WO-2025229200-A1 MANUFACTURE OF DISULFIDE BONDED PEPTIDES BACHEM HOLDING AG (CH) 2025-11-06 — — WO disclosed
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