SCHEMBL30176424

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC

nearest known ligand 0.63

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	VIPR1	P32241	5/20	0.63

▸	VIPR2	P41587	7/20	0.60

▸	PTH1R	Q03431	3/20	0.58

▸	TFPI	P10646	1/20	0.57

▸	GLP1R	P43220	3/20	0.55

▸	ECE1	P42892	1/20	0.55

▸	MUS81	Q96NY9	1/20	0.55

▸	GCGR	P47871	1/20	0.55

▸	GIPR	P48546	1/20	0.55

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
SCHEMBL29694510	0.94	VIPR2 (0.61)	VIPR1VIPR2PTH1RTFPI
SCHEMBL30432804	0.92	VIPR1 (0.70)	VIPR1VIPR2TFPIGLP1RECE1
SCHEMBL29694509	0.92	VIPR2 (0.66)	VIPR1VIPR2TFPI
SCHEMBL29694508	0.92	VIPR2 (0.66)	VIPR1VIPR2TFPIGLP1RECE1
SCHEMBL30432939	0.91	PTH1R (0.65)	VIPR1VIPR2PTH1RTFPIGLP1R
SCHEMBL31307250	0.91	VIPR2 (0.57)	VIPR1VIPR2
SCHEMBL29461568	0.91	VIPR2 (0.65)	VIPR1VIPR2TFPIGLP1R
SCHEMBL29679619	0.90	VIPR1 (0.63)	VIPR1VIPR2PTH1RTFPIGLP1R
SCHEMBL30262055	0.90	TFPI (0.62)	VIPR1VIPR2PTH1RTFPIGLP1R
SCHEMBL29453342	0.90	VIPR2 (0.63)	VIPR1VIPR2TFPIGLP1RGCGR

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
US-20230272394-A1	RNA-DIRECTED DNA CLEAVAGE BY THE Cas9-crRNA COMPLEX	VILNIUS UNIVERSITY (LT)	2023-08-31	—	—	US	disclosed
US-11555187-B2	RNA-directed DNA cleavage by the Cas9-crRNA complex	VILNIUS UNIVERSITY (LT)	2023-01-17	—	—	US	disclosed