SCHEMBL10908060

CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)NC(=O)CCCC(=O)O)C(C)C

nearest known ligand 0.51

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	CTSK	P43235	5/20	0.51

▸	CTSB	P07858	3/20	0.51

▸	CAPN1	P07384	3/20	0.49

▸	REN	P00797	2/20	0.49

▸	HTRA1	Q92743	2/20	0.49

▸	CASP3	P42574	3/20	0.48

▸	CASP7	P55210	2/20	0.48

▸	CAPN2	P17655	1/20	0.47

▸	PTPN1	P18031	1/20	0.47

▸	CTSL	P07711	2/20	0.46

▸	CASP1	P29466	1/20	0.46

▸	CASP9	P55211	1/20	0.46

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
SCHEMBL10909559	0.98	CTSK (0.51)	CTSKCTSBCAPN1RENHTRA1
SCHEMBL10908231	0.92	CTSK (0.47)	CTSKCTSBCAPN1RENHTRA1
SCHEMBL10907948	0.92	REN (0.48)	CTSKCTSBCAPN1RENHTRA1
SCHEMBL10909782	0.90	REN (0.48)	CTSKCTSBCAPN1RENHTRA1
SCHEMBL11012749	0.89	CTSL (0.48)	CTSKCTSBCTSL
SCHEMBL10905626	0.89	REN (0.46)	CTSKCTSBCAPN1RENHTRA1
SCHEMBL10909521	0.88	CTSK (0.43)	CTSKCTSBCAPN1RENHTRA1
SCHEMBL10908049	0.88	CTSK (0.49)	CTSKCTSBCAPN1RENHTRA1
SCHEMBL10905777	0.88	CTSK (0.49)	CTSKCTSBCAPN1RENHTRA1
SCHEMBL10909457	0.87	REN (0.54)	CTSKCTSBCAPN1RENHTRA1

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
US-4613676-A	PEPTIDES	CIBA-GEIGY CORPORATION (US)	1986-09-23	—	—	US	disclosed