SCHEMBL30176442

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)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](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C

nearest known ligand 0.64

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	VIPR2	P41587	7/20	0.64

▸	VIPR1	P32241	5/20	0.63

▸	TFPI	P10646	1/20	0.62

▸	PTH1R	Q03431	1/20	0.57

▸	BACE1	P56817	1/20	0.56

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
SCHEMBL30262016	0.95	TFPI (0.63)	VIPR2VIPR1TFPIPTH1R
SCHEMBL30432769	0.92	BACE1 (0.61)	VIPR2VIPR1BACE1
SCHEMBL31179921	0.92	TFPI (0.67)	VIPR2VIPR1TFPIPTH1R
SCHEMBL30277899	0.91	BACE1 (0.62)	VIPR2VIPR1TFPIBACE1
SCHEMBL30449398	0.91	VIPR1 (0.65)	VIPR2VIPR1TFPIPTH1R
SCHEMBL30495734	0.90	VIPR1 (0.62)	VIPR2VIPR1TFPIPTH1R
SCHEMBL30883259	0.90	TFPI (0.62)	VIPR2VIPR1TFPIBACE1
Skekigkefkrivqrikdflr SCHEMBL30338004	0.90	PTH1R (0.64)	VIPR2VIPR1TFPIPTH1R
SCHEMBL30712776	0.90	VIPR1 (0.61)	VIPR2VIPR1TFPIPTH1R
SCHEMBL31182934	0.90	RXFP1 (0.58)	VIPR2VIPR1TFPIPTH1R

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