SCHEMBL15959031

CC(c1ccc(-c2ccc(F)cc2F)cc1)N1CC[C@](CCN)(c2ccc(F)cc2)OC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	HSD11B1	P28845	20/20	1.00

▸	CYP3A4	P08684	10/20	1.00

▸	CYP2C9	P11712	4/20	0.86

▸	CYP2C19	P33261	3/20	0.86

▸	HSD3B2	P26439	1/20	0.86

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
SCHEMBL955579	1.00	HSD11B1 (1.00)	HSD11B1CYP3A4CYP2C9CYP2C19HSD3B2
SCHEMBL955581	1.00	HSD11B1 (1.00)	HSD11B1CYP3A4CYP2C9CYP2C19HSD3B2
SCHEMBL3643918	0.95	HSD11B1 (0.91)	HSD11B1CYP3A4CYP2C9CYP2C19HSD3B2
SCHEMBL15949359	0.95	HSD11B1 (0.91)	HSD11B1CYP3A4CYP2C9CYP2C19HSD3B2
SCHEMBL957398	0.95	HSD11B1 (1.00)	HSD11B1CYP3A4CYP2C9CYP2C19HSD3B2
SCHEMBL957397	0.95	HSD11B1 (1.00)	HSD11B1CYP3A4CYP2C9CYP2C19HSD3B2
SCHEMBL3644704	0.93	HSD11B1 (1.00)	HSD11B1CYP3A4CYP2C9CYP2C19HSD3B2
SCHEMBL734885	0.93	HSD11B1 (1.00)	HSD11B1CYP3A4CYP2C9CYP2C19HSD3B2
SCHEMBL15368374	0.93	HSD11B1 (0.86)	HSD11B1CYP3A4CYP2C9CYP2C19HSD3B2
SCHEMBL956892	0.93	HSD11B1 (1.00)	HSD11B1CYP3A4CYP2C9CYP2C19HSD3B2

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-2183228-B1	CYCLIC INHIBITORS OF 11ß -HYDROXYSTERIOD DEHYDROGENASE 1	VITAE PHARMACEUTICALS INC (US)	2014-08-20	—	—	EP	disclosed