SCHEMBL30578032

CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	KISS1R	Q969F8	2/20	0.62

▸	NPY4R	P50391	10/20	0.58

▸	NPY1R	P25929	7/20	0.58

▸	NPY2R	P49146	5/20	0.58

▸	NPY5R	Q15761	5/20	0.58

▸	VIPR1	P32241	3/20	0.57

▸	VIPR2	P41587	3/20	0.56

▸	TFPI	P10646	1/20	0.55

▸	ECE1	P42892	1/20	0.54

▸	GLP1R	P43220	1/20	0.54

▸	MUS81	Q96NY9	1/20	0.54

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
SCHEMBL29489541	0.94	VIPR1 (0.63)	KISS1RVIPR1VIPR2TFPIECE1
SCHEMBL30607388	0.94	VIPR1 (0.64)	KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL29580062	0.91	VIPR1 (0.63)	KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL31031604	0.90	NPY4R (0.63)	NPY4RNPY1RNPY2RNPY5RVIPR1
SCHEMBL29486242	0.90	KISS1R (0.62)	KISS1RVIPR1VIPR2TFPIECE1
SCHEMBL9401494	0.89	NPY4R (0.62)	KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL30602870	0.89	NPY4R (0.72)	NPY4RNPY1RNPY2RNPY5R
SCHEMBL31182826	0.89	VIPR1 (0.59)	KISS1RNPY4RNPY1RNPY5RVIPR1
SCHEMBL29458713	0.89	NPY4R (0.61)	KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL29857370	0.89	NPY4R (0.61)	KISS1RNPY4RNPY1RNPY2RNPY5R

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-20230374702-A1	METHOD FOR PREPARING A CONDITIONALLY ACTIVE ANTIBODY OR ANTIBODY FRAGMENT	BIOATLA, INC. (US)	2023-11-23	—	—	US	disclosed
US-11773509-B2	Conditionally active polypeptides and methods of generating them	BIOATLA, INC. (US)	2023-10-03	—	—	US	disclosed