SCHEMBL29569656

CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	PLK1	P53350	1/20	0.50

▸	APLNR	P35414	3/20	0.47

▸	KDM1A	O60341	1/20	0.47

▸	MAOB	P27338	1/20	0.47

▸	KDM5A	P29375	1/20	0.47

▸	KDM1B	Q8NB78	1/20	0.47

▸	C5AR1	P21730	1/20	0.47

▸	NTSR2	O95665	2/20	0.47

▸	NTSR1	P30989	2/20	0.47

▸	SORT1	Q99523	2/20	0.47

▸	OPRM1	P35372	6/20	0.46

▸	OPRK1	P41145	6/20	0.46

▸	RAMP3	O60896	3/20	0.46

▸	CALCR	P30988	3/20	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
SCHEMBL29568824	1.00	PLK1 (0.50)	PLK1APLNRKDM1AMAOBKDM5A
SCHEMBL29569046	1.00	PLK1 (0.50)	PLK1APLNRKDM1AMAOBKDM5A
SCHEMBL29569056	0.98	PLK1 (0.50)	PLK1APLNRKDM1AMAOBKDM5A
SCHEMBL29569638	0.97	APLNR (0.51)	PLK1APLNRKDM1AMAOBKDM5A
SCHEMBL29568955	0.97	APLNR (0.51)	PLK1APLNRKDM1AMAOBKDM5A
SCHEMBL29569043	0.97	APLNR (0.51)	PLK1APLNRKDM1AMAOBKDM5A
SCHEMBL29568619	0.96	APLNR (0.48)	PLK1APLNRKDM1AMAOBKDM5A
SCHEMBL29569098	0.96	APLNR (0.48)	PLK1APLNRKDM1AMAOBKDM5A
SCHEMBL29568813	0.96	APLNR (0.48)	PLK1APLNRKDM1AMAOBKDM5A
SCHEMBL29569088	0.94	PLK1 (0.49)	PLK1APLNRKDM1AMAOBKDM5A

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-3320923-B1	FLUORESCENT IMAGING AGENTS	VISEN MEDICAL INC (US)	2022-04-06	—	—	EP	disclosed