SCHEMBL30176464

CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC

nearest known ligand 0.62

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	PTH1R	Q03431	2/20	0.61

▸	GLP1R	P43220	7/20	0.61

▸	CALCR	P30988	3/20	0.59

▸	CRHR1	P34998	1/20	0.59

▸	CRHR2	Q13324	1/20	0.59

▸	VIPR1	P32241	2/20	0.58

▸	F2	P00734	4/20	0.58

▸	VIPR2	P41587	1/20	0.57

▸	SCTR	P47872	1/20	0.57

▸	CCKBR	P32239	1/20	0.57

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
SCHEMBL30176478	0.94	PTH1R (0.62)	PTH1RGLP1RCALCRCRHR1CRHR2
SCHEMBL30432505	0.92	GLP1R (0.66)	PTH1RGLP1RCALCRCRHR1CRHR2
SCHEMBL31182663	0.92	CALCR (0.63)	PTH1RGLP1RCALCRCRHR1CRHR2
SCHEMBL29750818	0.92	CALCR (0.66)	PTH1RGLP1RCALCRCRHR1CRHR2
SCHEMBL31182441	0.91	GLP1R (0.66)	GLP1RCALCRCRHR1CRHR2VIPR1
SCHEMBL25303269	0.91	CALCR (0.66)	PTH1RGLP1RCALCRCRHR1CRHR2
SCHEMBL29836025	0.91	CALCR (0.66)	PTH1RGLP1RCALCRCRHR1CRHR2
SCHEMBL719111	0.91	CALCR (0.66)	PTH1RGLP1RCALCRCRHR1CRHR2
SCHEMBL29628018	0.91	CALCR (0.66)	PTH1RGLP1RCALCRCRHR1CRHR2
SCHEMBL30436184	0.91	GLP1R (0.62)	PTH1RGLP1RSCTR

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
US-20230272394-A1	RNA-DIRECTED DNA CLEAVAGE BY THE Cas9-crRNA COMPLEX	VILNIUS UNIVERSITY (LT)	2023-08-31	—	—	US	disclosed
US-11555187-B2	RNA-directed DNA cleavage by the Cas9-crRNA complex	VILNIUS UNIVERSITY (LT)	2023-01-17	—	—	US	disclosed