Prednylidene

SCHEMBL28089752

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.C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NR3C1

The experimentally established mechanism targets of Prednylidene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

	gene	UniProt	supporting neighbours	confidence
▸	NR3C1 known ✓	P04150	9/20	0.72

▸	HSD17B10	Q99714	9/20	0.72

▸	HIF1A	Q16665	6/20	0.72

▸	PGR	P06401	4/20	0.72

▸	LMNA	P02545	3/20	0.72

▸	ALDH1A1	P00352	3/20	0.72

▸	KMT2A	Q03164	2/20	0.72

▸	MEN1	O00255	1/20	0.72

▸	SLC29A1	Q99808	1/20	0.72

▸	TDP1	Q9NUW8	1/20	0.72

▸	CYP3A4	P08684	4/20	0.71

▸	ABCB11	O95342	2/20	0.71

▸	SERPINA6	P08185	2/20	0.71

▸	TNF	P01375	1/20	0.71

▸	IL6	P05231	1/20	0.71

▸	NR3C2	P08235	1/20	0.71

▸	AR	P10275	1/20	0.71

▸	GLUL	P15104	1/20	0.71

▸	ADAM17	P78536	1/20	0.71

▸	GPBAR1	Q8TDU6	1/20	0.71

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
Prednisone SCHEMBL992150	0.92	HIF1A (0.85)	HSD17B10NR3C1HIF1APGRLMNA
Prednylidene SCHEMBL19327135	0.88	NR3C1 (0.70)	HSD17B10NR3C1HIF1APGRLMNA
Prednylidene SCHEMBL3291132	0.88	NR3C1 (0.70)	HSD17B10NR3C1HIF1APGRLMNA
Prednylidene SCHEMBL7568	0.88	NR3C1 (0.70)	HSD17B10NR3C1HIF1APGRLMNA
Prednylidene SCHEMBL1650347	0.88	NR3C1 (0.70)	HSD17B10NR3C1HIF1APGRLMNA
SCHEMBL10497306	0.85	HSD17B10 (0.70)	HSD17B10NR3C1HIF1APGRLMNA
Prednisone SCHEMBL23974933	0.85	HSD17B10 (1.00)	HSD17B10NR3C1HIF1APGRLMNA
Prednisone SCHEMBL8262569	0.85	HSD17B10 (1.00)	HSD17B10NR3C1HIF1APGRLMNA
Prednisone SCHEMBL21883168	0.85	HSD17B10 (1.00)	HSD17B10NR3C1HIF1APGRLMNA
Prednisone SCHEMBL21281533	0.85	HSD17B10 (1.00)	HSD17B10NR3C1HIF1APGRLMNA

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-106278999-B	S1P regulator	比奥根MA公司	2019-10-25	—	—	CN	disclosed
CN-106278999-A	S1p regulator	比奥根MA公司	2017-01-04	—	—	CN	disclosed
CN-103533835-B	S1P modulators	比奥根MA公司	2016-08-24	—	—	CN	disclosed