SCHEMBL19791189

CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	KISS1R	Q969F8	9/20	0.52

▸	IL23R	Q5VWK5	3/20	0.50

▸	PRMT1	Q99873	1/20	0.50

▸	ERAP2	Q6P179	1/20	0.48

▸	ACE	P12821	2/20	0.48

▸	MC4R	P32245	2/20	0.48

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
SCHEMBL19791161	0.92	IL23R (0.56)	KISS1RIL23RACE
SCHEMBL19791170	0.91	IL23R (0.56)	KISS1RIL23RPRMT1MC4R
SCHEMBL31345040	0.88	KISS1R (0.56)	KISS1RPRMT1ERAP2ACE
SCHEMBL19791186	0.88	KISS1R (0.55)	KISS1RIL23RPRMT1ERAP2ACE
SCHEMBL19791177	0.88	KISS1R (0.55)	KISS1RIL23RPRMT1ERAP2ACE
SCHEMBL19791252	0.87	KISS1R (0.55)	KISS1RIL23RPRMT1
SCHEMBL28235858	0.87	ACE (0.57)	ERAP2ACEMC4R
SCHEMBL29608623	0.87	KISS1R (0.53)	KISS1RPRMT1ACE
SCHEMBL30823583	0.85	KISS1R (0.71)	KISS1R
SCHEMBL30092902	0.84	KISS1R (0.52)	KISS1RPRMT1ACE

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
EP-3272765-A1	PEPTIDE DERIVATIVE FOR REGULATING THYMIC STROMAL LYMPHOID PROTEIN-MEDIATED SIGNALING AND PHARMACEUTICAL COMPOSITION FOR PREVENTING AND TREATING ALLERGY AND ASTHMA DISEASES COMPRISING SAME	Korea University Research and Business Foundation, Sejong Campus (KR)	2018-01-24	—	—	EP	disclosed