SCHEMBL10661503

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

nearest known ligand 0.57

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	PSEN1	P49768	11/20	0.57

▸	PSEN2	P49810	11/20	0.57

▸	APH1B	Q8WW43	11/20	0.57

▸	NCSTN	Q92542	11/20	0.57

▸	APH1A	Q96BI3	11/20	0.57

▸	PSENEN	Q9NZ42	11/20	0.57

▸	REN	P00797	8/20	0.54

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
SCHEMBL10659915	0.96	PSEN1 (0.59)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10665041	0.92	PSEN1 (0.49)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10665067	0.92	PSEN1 (0.49)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10662528	0.88	PSEN1 (0.62)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10661524	0.87	REN (0.71)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10662212	0.86	REN (0.60)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10659887	0.86	REN (0.60)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10665053	0.86	PSEN1 (0.53)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10825119	0.84	REN (0.58)	REN
SCHEMBL10657698	0.83	REN (0.55)	PSEN1PSEN2APH1BNCSTNAPH1A

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-4757050-A	Urea, amide group-containing	E. R. SQUIBB SONS, INC. (US)	1988-07-12	—	—	US	claimed
US-4757050-A	Urea, amide group-containing	E. R. SQUIBB SONS, INC. (US)	1988-07-12	—	—	US	disclosed