SCHEMBL30449142

CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)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)O)C(C)C

nearest known ligand 0.77

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	PTH1R	Q03431	12/20	0.77

▸	RXFP1	Q9HBX9	1/20	0.69

▸	GLP1R	P43220	6/20	0.66

▸	CCKBR	P32239	1/20	0.65

▸	KEAP1	Q14145	1/20	0.64

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.

Compound	similarity	top predicted	shared targets
SCHEMBL30449343	0.99	PTH1R (0.77)	PTH1RRXFP1GLP1RCCKBRKEAP1
Teriparatide SCHEMBL29394193	0.98	PTH1R (0.80)	PTH1RRXFP1GLP1RCCKBRKEAP1
Teriparatide SCHEMBL30448707	0.98	PTH1R (0.80)	PTH1RRXFP1GLP1RCCKBRKEAP1
SCHEMBL30255063	0.98	PTH1R (0.80)	PTH1RRXFP1GLP1RCCKBRKEAP1
SCHEMBL28980125	0.98	PTH1R (0.80)	PTH1RRXFP1GLP1RCCKBRKEAP1
Teriparatide SCHEMBL30645329	0.98	PTH1R (0.80)	PTH1RRXFP1GLP1RCCKBRKEAP1
SCHEMBL30975122	0.96	PTH1R (0.78)	PTH1RRXFP1GLP1RCCKBRKEAP1
Teriparatide SCHEMBL29357752	0.95	PTH1R (0.85)	PTH1RGLP1RCCKBR
SCHEMBL30449150	0.95	PTH1R (0.76)	PTH1RRXFP1GLP1RCCKBRKEAP1
SCHEMBL30449782	0.95	PTH1R (0.76)	PTH1RRXFP1GLP1RCCKBRKEAP1

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-116338064-A	Detection method of teriparatide	南京康舟医药科技有限公司	2023-06-27	—	—	CN	claimed
CN-116338064-A	Detection method of teriparatide	南京康舟医药科技有限公司	2023-06-27	—	—	CN	disclosed