SCHEMBL31041660

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

nearest known ligand 0.49

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	4/20	0.49

▸	C5AR1	P21730	2/20	0.48

▸	GLP1R	P43220	8/20	0.47

▸	SCTR	P47872	1/20	0.46

▸	BACE1	P56817	4/20	0.45

▸	CTSD	P07339	1/20	0.45

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
SCHEMBL31041718	0.99	CALCR (0.49)	CALCRC5AR1GLP1RSCTRBACE1
SCHEMBL31041736	0.96	CALCR (0.49)	CALCRC5AR1GLP1RSCTRBACE1
SCHEMBL31041721	0.96	CALCR (0.53)	CALCRC5AR1GLP1RSCTR
SCHEMBL31041672	0.95	CALCR (0.49)	CALCRC5AR1GLP1RSCTRBACE1
SCHEMBL31041723	0.94	BACE1 (0.47)	C5AR1GLP1RSCTRBACE1CTSD
SCHEMBL31041728	0.93	BACE1 (0.49)	C5AR1GLP1RSCTRBACE1CTSD
SCHEMBL31041749	0.92	CALCR (0.52)	CALCRC5AR1GLP1RSCTR
SCHEMBL31041767	0.91	CALCR (0.43)	CALCRC5AR1GLP1RSCTR
SCHEMBL30168695	0.91	CALCR (0.54)	CALCRGLP1RSCTRBACE1CTSD
SCHEMBL31041727	0.90	C5AR1 (0.49)	CALCRC5AR1GLP1RSCTRBACE1

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
CN-118184747-A	Polypeptide with breast cancer resisting activity and application thereof	苏州青锐生物科技有限公司	2024-06-14	—	—	CN	disclosed