SCHEMBL9852713

CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CCc1c[nH]cn1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	IL1RN	P18510	4/20	0.53

▸	ERAP2	Q6P179	4/20	0.53

▸	MMP2	P08253	1/20	0.51

▸	MMP9	P14780	1/20	0.51

▸	MMP8	P22894	1/20	0.51

▸	KISS1R	Q969F8	7/20	0.50

▸	ERAP1	Q9NZ08	2/20	0.49

▸	CCKBR	P32239	1/20	0.49

▸	ECE1	P42892	3/20	0.48

▸	PLG	P00747	1/20	0.47

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
SCHEMBL9852839	0.88	KISS1R (0.59)	KISS1R
SCHEMBL29384656	0.85	ERAP2 (0.62)	IL1RNERAP2MMP2MMP9MMP8
SCHEMBL29657706	0.84	ERAP2 (0.63)	IL1RNERAP2KISS1RERAP1
SCHEMBL30490006	0.84	ECE1 (0.56)	IL1RNERAP2MMP2MMP9MMP8
SCHEMBL31053729	0.84	GLP1R (0.57)	KISS1R
SCHEMBL11797417	0.84	GNRHR (0.56)	IL1RNERAP2MMP2MMP9MMP8
SCHEMBL11797437	0.84	GNRHR (0.56)	IL1RNERAP2MMP2MMP9MMP8
SCHEMBL30271245	0.83	ERAP1 (0.54)	IL1RNERAP2ERAP1
SCHEMBL29619552	0.83	OPRM1 (0.54)	IL1RNERAP2ERAP1
SCHEMBL29619512	0.83	OPRM1 (0.52)	IL1RNERAP2KISS1RERAP1

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
EP-0417454-A2	Reduced size LHRH analogs	ABBOTT LABORATORIES (US)	1991-03-20	—	—	EP	disclosed
EP-0328089-A2	Reduced size LHRH analogs	ABBOTT LABORATORIES (US)	1989-08-16	—	—	EP	disclosed