SCHEMBL30902823

CC(C)[C@H](NC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)OCc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	REN	P00797	3/20	0.55

▸	CTSD	P07339	3/20	0.55

▸	PSMB5	P28074	1/20	0.51

▸	CASP1	P29466	1/20	0.49

▸	CASP3	P42574	1/20	0.49

▸	CASP7	P55210	1/20	0.49

▸	CASP9	P55211	1/20	0.49

▸	CTSK	P43235	2/20	0.48

▸	CTSB	P07858	1/20	0.48

▸	KLK5	Q9Y337	1/20	0.46

▸	BACE1	P56817	3/20	0.46

▸	CTSS	P25774	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
SCHEMBL10051906	0.87	SYK (0.54)	CASP3CTSKKLK5BACE1CTSS
SCHEMBL11911350	0.87	SYK (0.54)	CASP3CTSKKLK5BACE1CTSS
SCHEMBL30902853	0.87	CTSD (0.45)	RENCTSDPSMB5CTSKCTSS
SCHEMBL10051910	0.86	REN (0.58)	RENCTSDCASP3CTSKCTSB
SCHEMBL25054179	0.84	CTSK (0.64)	PSMB5CTSKCTSBCTSS
SCHEMBL17109073	0.84	CTSK (0.59)	RENCTSKCTSBBACE1CTSS
SCHEMBL29202512	0.84	CTSK (0.64)	PSMB5CTSKCTSBCTSS
SCHEMBL15083094	0.82	ACE (0.49)	PSMB5CTSKKLK5CTSS
SCHEMBL23156955	0.82	ACE (0.49)	PSMB5CTSKKLK5CTSS
SCHEMBL7326125	0.82	ACE (0.66)	RENCTSDCTSKCTSBKLK5

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
WO-2024105205-A1	ANTIBODY-DRUG CONJUGATES (A2DCS) WITH ENZYMATICALLY CLEAVABLE GROUPS	BAYER AKTIENGESELLSCHAFT (DE)	2024-05-23	—	—	WO	disclosed