SCHEMBL30136453

SCHEMBL30136453

CSCC[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)C(C)C

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTH1R Q03431 13/20 0.69
▸ GLP1R P43220 5/20 0.63
▸ GCGR P47871 2/20 0.63
▸ GIPR P48546 1/20 0.63
▸ CCKBR P32239 1/20 0.58

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
SCHEMBL29407365 0.97 PTH1R (0.68) PTH1RGLP1RGCGRGIPRCCKBR
SCHEMBL30763287 0.95 PTH1R (0.67) PTH1RGLP1RGCGRGIPRCCKBR
SCHEMBL31473045 0.94 PTH1R (0.73) PTH1RGLP1RGCGRCCKBR
SCHEMBL30763299 0.94 PTH1R (0.73) PTH1RGLP1RGCGRCCKBR
SCHEMBL29860256 0.94 PTH1R (0.61) PTH1RGLP1RGCGR
Teriparatide SCHEMBL30448707 0.94 PTH1R (0.80) PTH1RGLP1RCCKBR
SCHEMBL28980125 0.94 PTH1R (0.80) PTH1RGLP1RCCKBR
Teriparatide SCHEMBL29394193 0.94 PTH1R (0.80) PTH1RGLP1RCCKBR
Teriparatide SCHEMBL30645329 0.94 PTH1R (0.80) PTH1RGLP1RCCKBR
SCHEMBL30255063 0.94 PTH1R (0.80) PTH1RGLP1RCCKBR

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
CN-110642936-B Method for preparing teriparatide 深圳翰宇药业股份有限公司 2023-01-17 — — CN disclosed
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