SCHEMBL6685138

CC(=O)OCC(=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]1[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3(F)[C@@H](O)C[C@@]12C.CCC(=O)O[C@H]1C[C@@]2(C)[C@@H](C[C@@H](C)[C@]2(OC(=O)CC)C(=O)SCF)[C@@H]2C[C@H](F)C3=CC(=O)C=C[C@]3(C)[C@@]12F

nearest known ligand 0.63

Predicted protein targets (top 20)

	gene	UniProt	supporting neighbours	confidence
▸	NR3C1	P04150	10/20	0.63

▸	PGR	P06401	7/20	0.63

▸	HIF1A	Q16665	7/20	0.63

▸	CYP3A4	P08684	5/20	0.63

▸	LMNA	P02545	5/20	0.63

▸	AR	P10275	4/20	0.63

▸	NR1I2	O75469	3/20	0.63

▸	ADORA3	P0DMS8	2/20	0.63

▸	ALDH1A1	P00352	2/20	0.63

▸	NR3C2	P08235	1/20	0.63

▸	MEN1	O00255	1/20	0.63

▸	KMT2A	Q03164	1/20	0.63

▸	MAPT	P10636	3/20	0.57

▸	CNR1	P21554	1/20	0.57

▸	KCNH2	Q12809	1/20	0.57

▸	NPSR1	Q6W5P4	1/20	0.57

▸	USP2	O75604	1/20	0.57

▸	DRD2	P14416	1/20	0.56

▸	OPRD1	P41143	1/20	0.56

▸	SMN1; SMN2	Q16637	1/20	0.56

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
Fluticasone Propionate SCHEMBL4281973	0.91	NR3C1 (0.70)	NR3C1PGRHIF1ACYP3A4LMNA
Fluocinonide SCHEMBL28188734	0.89	PGR (0.70)	NR3C1PGRHIF1ACYP3A4LMNA
Fluocinonide SCHEMBL11596245	0.85	NR3C1 (0.68)	NR3C1PGRHIF1ACYP3A4LMNA
Fluticasone Propionate SCHEMBL28089754	0.84	NR3C1 (0.70)	NR3C1PGRHIF1ACYP3A4LMNA
Fluticasone Propionate SCHEMBL1692230	0.84	NR3C1 (0.90)	NR3C1PGRHIF1ACYP3A4LMNA
Fluticasone Propionate SCHEMBL3369738	0.82	NR3C1 (0.86)	NR3C1PGRHIF1ACYP3A4LMNA
Fluocinonide SCHEMBL3475945	0.82	HIF1A (0.75)	NR3C1PGRHIF1ACYP3A4LMNA
Fluocinonide SCHEMBL28122375	0.82	HIF1A (0.75)	NR3C1PGRHIF1ACYP3A4LMNA
Formocortal SCHEMBL15438750	0.82	NR3C1 (0.57)	NR3C1PGRHIF1ACYP3A4LMNA
Beclomethasone Dipropionate SCHEMBL8538442	0.81	NR3C1 (0.68)	NR3C1PGRHIF1ACYP3A4LMNA

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-2004043534-A1	INERTIAL DRUG DELIVERY SYSTEM	COLLEGIUM PHARMACEUTICAL, INC. (US)	2004-05-27	—	—	WO	disclosed