SCHEMBL29993874

CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.61

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	C5AR1	P21730	2/20	0.61

▸	GRPR	P30550	3/20	0.55

▸	NMBR	P28336	2/20	0.55

▸	CTSL	P07711	3/20	0.54

▸	CTSS	P25774	3/20	0.54

▸	CTSK	P43235	3/20	0.54

▸	CTSH	P09668	1/20	0.54

▸	F2	P00734	4/20	0.53

▸	GLP1R	P43220	5/20	0.52

▸	GCGR	P47871	4/20	0.52

▸	IL23R	Q5VWK5	1/20	0.52

▸	GIPR	P48546	1/20	0.51

▸	CCKBR	P32239	1/20	0.51

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
SCHEMBL29557894	0.92	C5AR1 (0.59)	C5AR1GRPRNMBRCTSLCTSS
SCHEMBL30668090	0.91	C5AR1 (0.59)	C5AR1GRPRNMBRCTSLCTSS
SCHEMBL29398364	0.91	F2 (0.55)	C5AR1F2
SCHEMBL31038378	0.87	NMBR (0.63)	C5AR1GRPRNMBRF2GLP1R
SCHEMBL29743013	0.87	C5AR1 (0.59)	C5AR1GRPRNMBRGLP1RGCGR
SCHEMBL31694458	0.87	F2 (0.55)	C5AR1F2
SCHEMBL29993441	0.86	OPRM1 (0.59)	C5AR1IL23R
SCHEMBL30906336	0.86	GLP1R (0.61)	C5AR1GRPRNMBRGLP1RGCGR
SCHEMBL29794073	0.86	C5AR1 (0.68)	C5AR1GRPRNMBRCTSLCTSS
SCHEMBL29655807	0.86	C5AR1 (0.68)	C5AR1GRPRNMBRCTSLCTSS

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-20220251208-A1	Caninized Antibodies Against Canine CTLA-4	INTERVET INC. (US)	2022-08-11	—	—	US	disclosed