SCHEMBL7148546

CN(C)c1ccc([C@H]2C[C@@]3(C)[C@@H](CC[C@@]3(O)C=CCO)[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]32)cc1

nearest known ligand 0.65

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	PGR	P06401	16/20	0.65

▸	NR3C1	P04150	15/20	0.65

▸	AR	P10275	11/20	0.65

▸	CYP3A4	P08684	1/20	0.56

▸	CYP2C8	P10632	1/20	0.45

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
SCHEMBL4665348	1.00	PGR (0.65)	PGRNR3C1ARCYP3A4CYP2C8
SCHEMBL6453812	1.00	PGR (0.65)	PGRNR3C1ARCYP3A4CYP2C8
SCHEMBL7148540	1.00	PGR (0.65)	PGRNR3C1ARCYP3A4CYP2C8
SCHEMBL8541351	0.91	PGR (0.53)	PGRNR3C1ARCYP3A4
SCHEMBL8538261	0.91	PGR (0.53)	PGRNR3C1ARCYP3A4
SCHEMBL8541353	0.91	PGR (0.53)	PGRNR3C1ARCYP3A4
SCHEMBL8540843	0.89	PGR (0.53)	PGRNR3C1ARCYP3A4
SCHEMBL8539739	0.89	PGR (0.53)	PGRNR3C1ARCYP3A4
SCHEMBL8768021	0.89	PGR (0.53)	PGRNR3C1ARCYP3A4
SCHEMBL8536196	0.89	PGR (0.53)	PGRNR3C1ARCYP3A4

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
WO-2003099333-A1	METHODS OF CONTROLLING FERTILITY, CANCERS AND REPRODUCTIVE TRACT DISEASES	REPRODUCTIVE HEALTH TECHNOLOGIES, INC. (US)	2003-12-04	—	—	WO	disclosed