SCHEMBL29903297

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(N)=O)C(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O

nearest known ligand 0.71

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.71

▸	VIPR1	P32241	4/20	0.65

▸	GLP1R	P43220	4/20	0.63

▸	ECE1	P42892	1/20	0.63

▸	MUS81	Q96NY9	1/20	0.63

▸	VIPR2	P41587	5/20	0.62

▸	NR3C1	P04150	2/20	0.62

▸	GCGR	P47871	1/20	0.61

▸	GIPR	P48546	1/20	0.61

▸	SCTR	P47872	1/20	0.60

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
SCHEMBL30648448	0.97	TFPI (0.70)	TFPIVIPR1GLP1RECE1MUS81
SCHEMBL30436216	0.94	TFPI (0.79)	TFPIVIPR1GLP1RECE1MUS81
SCHEMBL30495775	0.94	VIPR1 (0.70)	TFPIVIPR1GLP1RECE1MUS81
SCHEMBL30974264	0.93	TFPI (0.63)	TFPIVIPR1GLP1RECE1MUS81
SCHEMBL30601869	0.93	TFPI (0.79)	TFPIVIPR1GLP1RECE1MUS81
SCHEMBL31683281	0.93	VIPR1 (0.72)	TFPIVIPR1GLP1RECE1MUS81
SCHEMBL30567756	0.93	VIPR1 (0.72)	TFPIVIPR1GLP1RECE1MUS81
SCHEMBL29649232	0.93	TFPI (0.66)	TFPIVIPR1GLP1RVIPR2GCGR
SCHEMBL31563800	0.92	VIPR1 (0.73)	TFPIVIPR1GLP1RECE1MUS81
SCHEMBL29453341	0.92	VIPR1 (0.72)	TFPIVIPR1GLP1RVIPR2NR3C1

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-107325188-B	Construction method and application of CHO cell strain of porcine serum protein fused with porcine circovirus Cap2 protein	唐山怡安生物工程有限公司	2022-08-23	—	—	CN	disclosed