SCHEMBL7966713

[2H]C(C(C)CCC(C)S)[C@@]([2H])(C(=O)C(c1ccccc1)C(S)C(OCc1ccco1)[C](C(=O)[C@H](CC(C)CCC(C)S)N(C)C(=O)[C@H](CC(C)C)NC)C(S)Cc1ccc(OCc2ccco2)cc1)N(C)C(=O)[C@H](CC(C)C)NC

nearest known ligand 0.32

Predicted protein targets (top 1)

	gene	UniProt	supporting neighbours	confidence
▸	ACACB	O00763	1/20	0.32

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
SCHEMBL7966242	0.88	MAOB (0.35)	—
SCHEMBL7966455	0.73	ACACB (0.37)	ACACB
SCHEMBL8129676	0.72	ACACB (0.38)	ACACB
SCHEMBL8133694	0.67	ACACB (0.39)	ACACB
SCHEMBL8125526	0.65	ACACB (0.36)	ACACB
SCHEMBL8140743	0.63	ACACB (0.38)	ACACB
SCHEMBL7561050	0.59	MME (0.33)	—
SCHEMBL7475849	0.57	BACE1 (0.37)	—
SCHEMBL7534852	0.55	MME (0.47)	—
SCHEMBL9101106	0.54	ACE (0.37)	—

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-6265537-B1	CYCLIC COMPOUNDS; NEMATOCIDES FOR HUMANS AND ANIMALS	BAYER AKTIENGESELLSCHAFT (DE)	2001-07-24	—	—	US	disclosed