Prednylidene

SCHEMBL6257149

C=C1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO.COC(=O)[C@@]1(C)[C@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

	gene	UniProt	supporting neighbours	confidence
▸	NR3C1	P04150	11/20	0.66

▸	PGR	P06401	5/20	0.64

▸	HIF1A	Q16665	5/20	0.64

▸	LMNA	P02545	2/20	0.64

▸	NR1I2	O75469	1/20	0.64

▸	CNR1	P21554	1/20	0.64

▸	CYP3A4	P08684	4/20	0.57

▸	HSD17B10	Q99714	3/20	0.57

▸	ABCB11	O95342	2/20	0.57

▸	NR3C2	P08235	2/20	0.57

▸	AR	P10275	2/20	0.57

▸	TNF	P01375	1/20	0.57

▸	IL6	P05231	1/20	0.57

▸	SERPINA6	P08185	1/20	0.57

▸	GLUL	P15104	1/20	0.57

▸	ADAM17	P78536	1/20	0.57

▸	GPBAR1	Q8TDU6	1/20	0.57

▸	CYP2C19	P33261	1/20	0.57

▸	ABCC3	O15438	1/20	0.51

▸	ABCC4	O15439	1/20	0.51

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
Prednylidene SCHEMBL28086556	0.91	NR3C1 (0.79)	NR3C1PGRHIF1ALMNANR1I2
Prednylidene SCHEMBL19327135	0.88	NR3C1 (0.70)	NR3C1PGRHIF1ALMNANR1I2
Prednylidene SCHEMBL3291132	0.88	NR3C1 (0.70)	NR3C1PGRHIF1ALMNANR1I2
Prednylidene SCHEMBL1650347	0.88	NR3C1 (0.70)	NR3C1PGRHIF1ALMNANR1I2
Prednylidene SCHEMBL7568	0.88	NR3C1 (0.70)	NR3C1PGRHIF1ALMNANR1I2
SCHEMBL4149	0.87	NR3C1 (0.76)	NR3C1PGRHIF1ALMNANR1I2
Rimexolone SCHEMBL19327140	0.85	NR3C1 (0.88)	NR3C1PGRHIF1ALMNANR1I2
SCHEMBL11846698	0.81	NR3C1 (0.61)	NR3C1PGRHIF1ALMNANR1I2
SCHEMBL11846691	0.81	NR3C1 (0.61)	NR3C1PGRHIF1ALMNANR1I2
SCHEMBL11856728	0.81	NR3C1 (0.61)	NR3C1PGRHIF1ALMNANR1I2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
WO-2005065185-A2	TEMPERATURE-STABLE FORMULATIONS, AND METHODS OF DEVELOPMENT THEREOF	COLLEGIUM PHARMACEUTICALS, INC. (US)	2005-07-21	—	—	WO	disclosed
US-20050153946-A1	Temperature-stable formulations, and methods of development thereof	COLLEGIUM PHARMACEUTICALS, INC. (US)	2005-07-14	—	—	US	disclosed