SCHEMBL31301705

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

nearest known ligand 0.58

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.58

▸	IL23R	Q5VWK5	6/20	0.52

▸	KEAP1	Q14145	1/20	0.50

▸	NPY1R	P25929	2/20	0.48

▸	NPY2R	P49146	2/20	0.48

▸	NPY4R	P50391	2/20	0.48

▸	NPY5R	Q15761	2/20	0.48

▸	OPRL1	P41146	1/20	0.48

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
SCHEMBL30350761	0.97	TFPI (0.62)	TFPIIL23RKEAP1OPRL1
SCHEMBL30562937	0.97	TFPI (0.62)	TFPIIL23RKEAP1OPRL1
SCHEMBL30354443	0.91	NPY4R (0.55)	TFPIIL23RKEAP1NPY1RNPY2R
SCHEMBL30521958	0.91	NPY4R (0.53)	TFPIIL23RNPY1RNPY2RNPY4R
SCHEMBL31013870	0.91	NPY4R (0.55)	TFPIIL23RKEAP1NPY1RNPY2R
SCHEMBL31301806	0.90	NPY4R (0.54)	TFPINPY1RNPY2RNPY4RNPY5R
SCHEMBL29670861	0.90	QRFPR (0.54)	TFPIIL23RNPY1RNPY2RNPY4R
SCHEMBL29670860	0.90	QRFPR (0.57)	TFPIIL23RNPY1RNPY2RNPY4R
SCHEMBL13107806	0.89	NPY4R (0.53)	IL23RNPY1RNPY2RNPY4RNPY5R
SCHEMBL30509261	0.89	NPY4R (0.53)	IL23RNPY1RNPY2RNPY4RNPY5R

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-119390854-A	Polypeptide Tat-CIRP and application thereof	南通大学	2025-02-07	—	—	CN	disclosed