SCHEMBL13435737

CC(C)(C)OC(=O)N[C@H]1CCCCCCC[C@@H]2C[C@@]2(C(N)=O)NC(=O)[C@@H]2C[C@@H](OC(=O)N3Cc4cccc(F)c4C3)CN2C1=O

nearest known ligand 0.38

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	DDB1	Q16531	1/20	0.37

▸	CRBN	Q96SW2	1/20	0.37

▸	RAMP1	O60894	3/20	0.31

▸	CALCRL	Q16602	3/20	0.31

▸	SCN9A	Q15858	3/20	0.31

▸	ADRB3	P13945	1/20	0.31

▸	ADRA2B	P18089	1/20	0.31

▸	ADRA2C	P18825	1/20	0.31

▸	REN	P00797	1/20	0.31

▸	HSD11B1	P28845	2/20	0.31

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
SCHEMBL3375539	0.94	DDB1 (0.36)	DDB1CRBNRAMP1CALCRLSCN9A
SCHEMBL13757915	0.94	DDB1 (0.36)	DDB1CRBNRAMP1CALCRLSCN9A
SCHEMBL3375346	0.94	DDB1 (0.36)	DDB1CRBNRAMP1CALCRLSCN9A
SCHEMBL8179857	0.94	DDB1 (0.36)	DDB1CRBNRAMP1CALCRLSCN9A
SCHEMBL13798450	0.93	DDB1 (0.35)	DDB1CRBNRAMP1CALCRLSCN9A
SCHEMBL13798430	0.91	DDB1 (0.34)	DDB1CRBNSCN9AADRB3ADRA2B
SCHEMBL13798318	0.91	DDB1 (0.34)	DDB1CRBNRAMP1CALCRLSCN9A
SCHEMBL19236428	0.91	ADRB3 (0.39)	DDB1CRBNADRB3ADRA2BADRA2C
SCHEMBL13798426	0.91	DDB1 (0.33)	DDB1CRBNRAMP1CALCRLSCN9A
SCHEMBL11983993	0.91	ADRB3 (0.39)	DDB1CRBNADRB3ADRA2BADRA2C

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-2177523-A1	Novel macrocyclic inhibitors of hepatitis c virus replication	Intermune, Inc. (US)	2010-04-21	—	—	EP	disclosed