SCHEMBL8427152

C=C1CCO[C@@]12CC[C@H]1[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3[C@@H](c3ccc(-c4ccc(C#N)cc4)cc3)C[C@@]12C

nearest known ligand 0.74

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	PGR	P06401	14/20	0.74

▸	NR3C1	P04150	13/20	0.51

▸	AR	P10275	7/20	0.51

▸	CYP3A4	P08684	3/20	0.48

▸	LMNA	P02545	2/20	0.40

▸	ABCB11	O95342	2/20	0.40

▸	TSHR	P16473	1/20	0.40

▸	CYP2C19	P33261	1/20	0.40

▸	HIF1A	Q16665	1/20	0.40

▸	ALDH1A1	P00352	1/20	0.40

▸	ESR1	P03372	1/20	0.40

▸	SHBG	P04278	1/20	0.40

▸	ADRA2A	P08913	1/20	0.40

▸	SLC6A4	P31645	1/20	0.40

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
SCHEMBL8427156	1.00	PGR (0.74)	PGRNR3C1ARCYP3A4LMNA
SCHEMBL8427053	0.87	PGR (0.81)	PGRNR3C1ARCYP3A4LMNA
SCHEMBL8427242	0.87	PGR (0.81)	PGRNR3C1ARCYP3A4LMNA
SCHEMBL8424666	0.85	PGR (0.71)	PGRNR3C1ARCYP3A4
SCHEMBL8423175	0.85	PGR (1.00)	PGRNR3C1ARCYP3A4
SCHEMBL8424832	0.85	PGR (0.79)	PGRNR3C1ARCYP3A4LMNA
SCHEMBL9019799	0.83	NR3C1 (0.63)	PGRNR3C1ARCYP3A4LMNA
SCHEMBL8423485	0.82	PGR (0.73)	PGRNR3C1ARCYP3A4ABCB11
SCHEMBL5497957	0.82	PGR (0.53)	PGRNR3C1ARCYP3A4LMNA
SCHEMBL5497953	0.82	PGR (0.53)	PGRNR3C1ARCYP3A4LMNA

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-0582338-B1	17-Spiromethylene steroids	AKZO NOBEL NV (NL)	1999-10-20	—	—	EP	disclosed