SCHEMBL1040069

COCCCN1CCOc2ccc(CO[C@H]3CN(C(=O)O)C(C(C)(C)C)[C@@H](OCC[C@@H](C)OS(C)(=O)=O)[C@H]3c3ccc(COCCOC)cc3)cc21

nearest known ligand 0.32

Predicted protein targets (top 2)

	gene	UniProt	supporting neighbours	confidence
▸	RORC	P51449	5/20	0.32

▸	REN	P00797	1/20	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
SCHEMBL1040451	0.92	REN (0.33)	RORCREN
SCHEMBL1040452	0.92	REN (0.33)	RORCREN
SCHEMBL1040567	0.90	REN (0.31)	RORCREN
SCHEMBL1040565	0.90	REN (0.31)	RORCREN
SCHEMBL1039533	0.89	RORC (0.33)	RORCREN
SCHEMBL3946657	0.89	RORC (0.34)	RORCREN
SCHEMBL1040068	0.86	RORC (0.33)	RORCREN
SCHEMBL1038043	0.86	RORC (0.32)	RORCREN
SCHEMBL1040429	0.85	REN (0.35)	REN
SCHEMBL1039409	0.85	RORC (0.34)	RORCREN

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-2049514-B1	NITRATE ESTERS OF PIPERIDINES	NOVARTIS AG (CH)	2011-01-26	—	—	EP	disclosed