SCHEMBL29983249

CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)C(C)C)C(C)C)[C@@H](C)O)C(N)=O

nearest known ligand 0.69

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	NR3C1	P04150	6/20	0.69

▸	IL23R	Q5VWK5	5/20	0.67

▸	GLP1R	P43220	7/20	0.65

▸	CCKBR	P32239	1/20	0.62

▸	GRPR	P30550	1/20	0.62

▸	ECE1	P42892	1/20	0.62

▸	MUS81	Q96NY9	1/20	0.62

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
SCHEMBL29358003	0.97	NR3C1 (0.66)	NR3C1IL23RGLP1RECE1MUS81
SCHEMBL29491080	0.91	NR3C1 (0.76)	NR3C1IL23RGLP1RCCKBRECE1
SCHEMBL29736869	0.89	NR3C1 (0.72)	NR3C1IL23RGLP1RCCKBRGRPR
SCHEMBL30008855	0.88	NR3C1 (0.70)	NR3C1IL23RGLP1RCCKBRECE1
SCHEMBL29736864	0.88	NR3C1 (0.72)	NR3C1IL23RGLP1RCCKBRECE1
SCHEMBL31140800	0.87	GLP1R (0.70)	NR3C1GLP1RCCKBRECE1MUS81
SCHEMBL29351278	0.86	GLP1R (0.69)	GLP1RCCKBR
SCHEMBL29097470	0.86	NR3C1 (0.61)	NR3C1IL23RGLP1RCCKBRECE1
SCHEMBL31514295	0.85	NPBWR1 (0.69)	NR3C1IL23RGLP1RECE1MUS81
Lycotoxin I SCHEMBL29412262	0.85	GLP1R (0.66)	NR3C1GLP1RCCKBRECE1MUS81

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-20230047825-A1	ANTIMICROBIAL PEPTIDES	KING S COLLEGE LONDON (GB)	2023-02-16	—	—	US	disclosed
EP-4069721-A1	ANTIMICROBIAL PEPTIDES	King's College London (GB)	2022-10-12	—	—	EP	disclosed