SCHEMBL30716931

CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR1	P30989	14/20	0.55

▸	NTSR2	O95665	13/20	0.55

▸	SORT1	Q99523	11/20	0.55

▸	GRB2	P62993	1/20	0.55

▸	AGTR2	P50052	4/20	0.52

▸	AGTR1	P30556	3/20	0.52

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
SCHEMBL11857309	0.88	NTSR2 (0.46)	NTSR1NTSR2SORT1GRB2AGTR2
SCHEMBL11857288	0.88	NTSR2 (0.46)	NTSR1NTSR2SORT1GRB2AGTR2
SCHEMBL11866246	0.80	TGM2 (0.44)	—
SCHEMBL11866232	0.80	TGM2 (0.44)	—
SCHEMBL29350954	0.79	DPP4 (0.63)	GRB2
SCHEMBL30411733	0.78	GRB2 (0.54)	NTSR1NTSR2SORT1GRB2AGTR2
SCHEMBL31362663	0.78	CAPN1 (0.51)	NTSR1NTSR2SORT1
Teprotide SCHEMBL613757	0.77	GNRHR (0.57)	—
SCHEMBL31289489	0.77	XIAP (0.52)	NTSR1NTSR2SORT1AGTR2AGTR1
SCHEMBL29598550	0.77	OPRM1 (0.44)	GRB2

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-117413064-A	Seamless integration of engineered zinc fingers into endogenous transcription factors to take advantage of their natural function	纽约大学	2024-01-16	—	—	CN	disclosed