SCHEMBL30658365

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

nearest known ligand 0.69

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	PTH1R	Q03431	9/20	0.69

▸	RXFP1	Q9HBX9	4/20	0.68

▸	GLP1R	P43220	5/20	0.65

▸	CCKBR	P32239	1/20	0.65

▸	KEAP1	Q14145	2/20	0.65

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
SCHEMBL30658384	0.96	RXFP1 (0.71)	PTH1RRXFP1GLP1RCCKBRKEAP1
SCHEMBL30495686	0.94	PTH1R (0.67)	PTH1RRXFP1GLP1RCCKBRKEAP1
SCHEMBL31182447	0.93	PTH1R (0.73)	PTH1RRXFP1GLP1RCCKBRKEAP1
SCHEMBL30448747	0.93	PTH1R (0.75)	PTH1RRXFP1GLP1RCCKBRKEAP1
SCHEMBL30449343	0.93	PTH1R (0.77)	PTH1RRXFP1GLP1RCCKBRKEAP1
SCHEMBL30449142	0.93	PTH1R (0.77)	PTH1RRXFP1GLP1RCCKBRKEAP1
SCHEMBL29949645	0.93	PTH1R (0.68)	PTH1RRXFP1GLP1RCCKBRKEAP1
Teriparatide SCHEMBL29394193	0.92	PTH1R (0.80)	PTH1RRXFP1GLP1RCCKBRKEAP1
Teriparatide SCHEMBL30448707	0.92	PTH1R (0.80)	PTH1RRXFP1GLP1RCCKBRKEAP1
SCHEMBL30255063	0.92	PTH1R (0.80)	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 1 patent. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-11753627-B2	Dengue tetravalent vaccine containing a common 30 nucleotide deletion in the 3′-UTR of dengue types 1,2,3, and 4, or antigenic chimeric dengue viruses 1,2,3, and 4	THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US)	2023-09-12	—	—	US	disclosed