SCHEMBL8092240

C[C@H]1C[C@H]2N(C)C(=O)CC[C@]2(C)[C@H]2CC[C@]3(C)C(c4cccc5ccccc45)=CC[C@H]3[C@H]12

nearest known ligand 0.49

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	SRD5A1	P18405	12/20	0.45

▸	SRD5A2	P31213	10/20	0.45

▸	CDK8	P49336	1/20	0.37

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
SCHEMBL8097142	1.00	SRD5A1 (0.45)	SRD5A1SRD5A2CDK8
SCHEMBL8092265	0.85	SRD5A1 (0.45)	SRD5A1SRD5A2
SCHEMBL8092260	0.85	SRD5A1 (0.45)	SRD5A1SRD5A2
SCHEMBL8084004	0.85	SRD5A1 (0.49)	SRD5A1SRD5A2
SCHEMBL8084007	0.85	SRD5A1 (0.49)	SRD5A1SRD5A2
SCHEMBL8084014	0.81	SRD5A1 (0.46)	SRD5A1SRD5A2
SCHEMBL8084018	0.81	SRD5A1 (0.46)	SRD5A1SRD5A2
SCHEMBL8084472	0.80	SRD5A1 (0.51)	SRD5A1SRD5A2
SCHEMBL8084476	0.80	SRD5A1 (0.51)	SRD5A1SRD5A2
SCHEMBL8096725	0.79	SRD5A1 (0.48)	SRD5A1SRD5A2

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-0756481-B1	17$g(b)-ARYL-4-AZA-STEROID DERIVATIVES	MERCK & CO INC (US)	2000-12-27	—	—	EP	claimed