SCHEMBL6673557

C[C@@]12CCC[C@H]1[C@@H]1CCC3NC(=O)C=C(C4CC[C@H]5[C@@H]6CC=C7NC(=O)CC[C@]7(C)[C@@H]6CC[C@]45C)[C@]3(C)[C@@H]1CC2

nearest known ligand 0.46

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	SRD5A1	P18405	3/20	0.45

▸	SRD5A2	P31213	5/20	0.37

▸	CYP17A1	P05093	3/20	0.37

▸	CYP19A1	P11511	4/20	0.34

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
SCHEMBL5183886	0.78	SRD5A1 (0.53)	SRD5A1SRD5A2CYP17A1CYP19A1
SCHEMBL5183889	0.78	SRD5A1 (0.53)	SRD5A1SRD5A2CYP17A1CYP19A1
SCHEMBL6673554	0.78	SRD5A1 (0.42)	SRD5A1SRD5A2
SCHEMBL6673559	0.74	KDM4E (0.44)	SRD5A1SRD5A2
SCHEMBL5109018	0.70	CYP19A1 (0.44)	SRD5A1SRD5A2CYP19A1
SCHEMBL7617295	0.69	SRD5A1 (0.64)	SRD5A1CYP19A1
SCHEMBL7617290	0.69	SRD5A1 (0.64)	SRD5A1CYP19A1
SCHEMBL5244072	0.68	SRD5A1 (0.57)	SRD5A1SRD5A2CYP17A1
SCHEMBL5244078	0.68	SRD5A1 (0.57)	SRD5A1SRD5A2CYP17A1
SCHEMBL13970856	0.67	SRD5A1 (0.54)	SRD5A1SRD5A2CYP17A1CYP19A1

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-1335930-B1	Process for the preparation of 3-oxo-4-azasteroids	GLAXO GROUP LTD (GB)	2004-10-13	—	—	EP	claimed