SCHEMBL29679723

CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	7/20	0.55

▸	CALCRL	Q16602	1/20	0.49

▸	REN	P00797	3/20	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
SCHEMBL29679964	0.91	OPRD1 (0.64)	OPRD1
SCHEMBL29679968	0.89	OPRD1 (0.56)	OPRD1
SCHEMBL29679773	0.84	OPRD1 (0.64)	OPRD1
SCHEMBL30586584	0.84	OPRD1 (0.59)	OPRD1REN
SCHEMBL30712927	0.83	NPY2R (0.59)	OPRD1
SCHEMBL30528331	0.82	OPRD1 (0.54)	OPRD1REN
SCHEMBL7760134	0.81	ACE (0.54)	OPRD1CALCRL
SCHEMBL7760143	0.81	ACE (0.54)	OPRD1CALCRL
SCHEMBL31461943	0.81	OPRD1 (0.63)	OPRD1
SCHEMBL30350078	0.81	OPRD1 (0.61)	OPRD1

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
WO-2022069704-A2	IMMUNODIAGNOSTIC AGENTS AND METHODS FOR THE DETECTION AND DIFFERENTIATION OF CORONAVIRUS INFECTIONS	INSTITUT FÜR MOLEKULARE DIAGNOSTIK UND BIOANALYTIK (IMDB) GGMBH (DE)	2022-04-07	—	—	WO	disclosed