SCHEMBL30816279

CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	6/20	0.49

▸	OPRM1	P35372	5/20	0.49

▸	ACE	P12821	2/20	0.48

▸	MME	P08473	1/20	0.48

▸	CPA1	P15085	1/20	0.48

▸	ACE2	Q9BYF1	1/20	0.48

▸	BACE1	P56817	1/20	0.47

▸	KISS1R	Q969F8	2/20	0.47

▸	OPRK1	P41145	2/20	0.47

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
SCHEMBL32675882	0.93	NTSR2 (0.50)	OPRD1BACE1KISS1R
SCHEMBL31020746	0.86	BACE1 (0.59)	ACEMMECPA1ACE2BACE1
SCHEMBL29469220	0.85	BACE1 (0.60)	BACE1KISS1R
SCHEMBL31197208	0.85	BACE1 (0.55)	ACEMMECPA1ACE2BACE1
SCHEMBL29608731	0.84	OPRD1 (0.55)	OPRD1OPRM1BACE1OPRK1
SCHEMBL30299009	0.84	OPRM1 (0.55)	OPRD1OPRM1BACE1KISS1ROPRK1
SCHEMBL29630541	0.84	BACE1 (0.56)	ACEMMECPA1ACE2BACE1
SCHEMBL29960149	0.84	KISS1R (0.55)	ACEMMECPA1ACE2BACE1
SCHEMBL31257031	0.84	OPRD1 (0.53)	OPRD1OPRM1BACE1OPRK1
SCHEMBL30887562	0.84	OPRD1 (0.64)	OPRD1OPRM1KISS1ROPRK1

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
US-20240059758-A1	THERAPEUTIC ANTIBODIES WITH NEUTRALIZING ACTIVITY AGAINST SARS-COV-2 GLYCOPROTEIN S	CORAT THERAPEUTICS GMBH (DE)	2024-02-22	—	—	US	claimed