SCHEMBL29466810

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(C)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.67

▸	GLP1R	P43220	4/20	0.56

▸	RXFP1	Q9HBX9	1/20	0.56

▸	OPRL1	P41146	1/20	0.54

▸	GRIN2D	O15399	1/20	0.54

▸	GRIN3B	O60391	1/20	0.54

▸	GRIN1	Q05586	1/20	0.54

▸	GRIN2A	Q12879	1/20	0.54

▸	GRIN2B	Q13224	1/20	0.54

▸	GRIN2C	Q14957	1/20	0.54

▸	GRIN3A	Q8TCU5	1/20	0.54

▸	BACE1	P56817	1/20	0.54

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
SCHEMBL31242354	0.99	TFPI (0.67)	TFPIGLP1RRXFP1OPRL1GRIN2D
SCHEMBL29466813	0.96	TFPI (0.70)	TFPIGLP1RRXFP1OPRL1GRIN2D
SCHEMBL29466809	0.96	TFPI (0.70)	TFPIGLP1RRXFP1OPRL1GRIN2D
SCHEMBL30769537	0.92	TFPI (0.65)	TFPIGLP1RRXFP1OPRL1
SCHEMBL30900786	0.92	TFPI (0.66)	TFPIGLP1R
SCHEMBL30900789	0.92	TFPI (0.66)	TFPIGLP1R
SCHEMBL30447212	0.91	TFPI (0.64)	TFPIGLP1RRXFP1
SCHEMBL30446700	0.90	TFPI (0.63)	TFPIGLP1RRXFP1
SCHEMBL30900775	0.90	TFPI (0.69)	TFPIGLP1RRXFP1
SCHEMBL29743325	0.90	BACE1 (0.57)	TFPIGLP1RBACE1

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-114206916-A	Restricted peptides	缇尔索卢森公司	2022-03-18	—	—	CN	disclosed