SCHEMBL29812486

C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](CSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.48

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	MDM4	O15151	2/20	0.43

▸	TP53	P04637	2/20	0.43

▸	CASP3	P42574	3/20	0.41

▸	KMT2A	Q03164	1/20	0.40

▸	PTPN1	P18031	3/20	0.38

▸	SLC17A5	Q9NRA2	1/20	0.38

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
SCHEMBL18764578	0.92	CASP3 (0.49)	MDM4TP53CASP3KMT2APTPN1
SCHEMBL30758116	0.92	PTPN1 (0.45)	MDM4TP53CASP3PTPN1
SCHEMBL30758115	0.91	PTPN1 (0.45)	MDM4TP53PTPN1
SCHEMBL20545940	0.89	MDM4 (0.45)	MDM4TP53CASP3KMT2APTPN1
SCHEMBL30529863	0.88	CASP3 (0.42)	MDM4TP53CASP3KMT2APTPN1
SCHEMBL29812620	0.87	MDM4 (0.44)	MDM4TP53CASP3KMT2A
SCHEMBL18790463	0.87	CASP3 (0.49)	MDM4TP53CASP3KMT2APTPN1
SCHEMBL29519883	0.86	CASP3 (0.50)	MDM4TP53CASP3KMT2A
SCHEMBL2193899	0.86	CASP3 (0.43)	MDM4TP53CASP3KMT2APTPN1
SCHEMBL2193892	0.86	CASP3 (0.43)	MDM4TP53CASP3KMT2APTPN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
WO-2023231969-A1	INSULIN HYBRID PEPTIDE COMPRISING CHYMOTRYPSIN INHIBITORY PEPTIDE, AND USE THEREOF	中国医学科学院药物研究所	2023-12-07	—	—	WO	disclosed
WO-2022111713-A1	POLYPEPTIDE CONTAINING DISULFIDE BONDS AND CAPABLE OF INHIBITING ACTIVITY OF SERINE PROTEASE, DERIVED HYBRID PEPTIDE THEREOF, AND USE THEREOF	中国医学科学院药物研究所	2022-06-02	—	—	WO	disclosed