SCHEMBL29679604

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	RAMP3	O60896	14/20	0.57

▸	CALCR	P30988	14/20	0.57

▸	NPY2R	P49146	5/20	0.52

▸	NPY4R	P50391	5/20	0.52

▸	NPY5R	Q15761	5/20	0.52

▸	NPY1R	P25929	3/20	0.52

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
SCHEMBL29680011	0.97	RAMP3 (0.56)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL29680080	0.96	RAMP3 (0.56)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30429353	0.96	RAMP3 (0.56)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL29679504	0.93	RAMP3 (0.57)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30974402	0.93	NPY2R (0.55)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31285039	0.93	OPRM1 (0.50)	RAMP3CALCR
SCHEMBL30844242	0.92	NPY2R (0.53)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30844316	0.90	NPY2R (0.51)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30571126	0.90	RAMP3 (0.54)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30785127	0.90	OPRM1 (0.51)	RAMP3CALCR

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
WO-2022069704-A2	IMMUNODIAGNOSTIC AGENTS AND METHODS FOR THE DETECTION AND DIFFERENTIATION OF CORONAVIRUS INFECTIONS	INSTITUT FÜR MOLEKULARE DIAGNOSTIK UND BIOANALYTIK (IMDB) GGMBH (DE)	2022-04-07	—	—	WO	disclosed