SCHEMBL3391119

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4CC(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.79

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	NR1H4	Q96RI1	3/20	0.79

▸	HPSE	Q9Y251	12/20	0.65

▸	VDR	P11473	1/20	0.64

▸	FGF1	P05230	7/20	0.61

▸	CDC25A	P30304	2/20	0.61

▸	POLA1	P09884	1/20	0.60

▸	FGF2	P09038	6/20	0.60

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
SCHEMBL11410558	1.00	NR1H4 (0.79)	NR1H4HPSEVDRFGF1CDC25A
SCHEMBL26642428	1.00	NR1H4 (0.79)	NR1H4HPSEVDRFGF1CDC25A
SCHEMBL26642434	1.00	NR1H4 (0.79)	NR1H4HPSEVDRFGF1CDC25A
SCHEMBL30653065	1.00	NR1H4 (0.79)	NR1H4HPSEVDRFGF1CDC25A
SCHEMBL15369124	0.94	NR1H4 (0.70)	NR1H4HPSEFGF1FGF2
SCHEMBL2059166	0.89	NR1H4 (0.68)	NR1H4HPSEFGF1CDC25APOLA1
SCHEMBL12590999	0.89	NR1H4 (0.68)	NR1H4HPSEFGF1CDC25APOLA1
SCHEMBL13211407	0.89	NR1H4 (0.68)	NR1H4HPSEFGF1CDC25APOLA1
SCHEMBL479186	0.89	NR1H4 (1.00)	NR1H4VDR
SCHEMBL31145546	0.89	NR1H4 (0.77)	NR1H4HPSEVDRFGF1FGF2

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-2010048710-A1	NEUROTOXIC STEROL GLYCOSIDES	NEURODYN, INC. (CA)	2010-05-06	—	—	WO	disclosed