SCHEMBL10635071

C=C(CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)CCC(O)[C@@]45C[C@@]35CC[C@]12C)C(C)C.CC(C)CCC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)CC=C(O)[C@@]45C[C@@]35CC[C@]12C

nearest known ligand 0.40

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	HSD11B1	P28845	4/20	0.40

▸	HMGCR	P04035	2/20	0.37

▸	EBP	Q15125	8/20	0.37

▸	ACLY	P53396	2/20	0.36

▸	ACACA	Q13085	2/20	0.36

▸	PTPN11	Q06124	1/20	0.33

▸	NR1H3	Q13133	1/20	0.32

▸	PTGS1	P23219	1/20	0.31

▸	PTGS2	P35354	1/20	0.31

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
SCHEMBL6341662	0.93	HSD11B1 (0.45)	HSD11B1HMGCREBPACLYACACA
SCHEMBL464758	0.88	HSD11B1 (0.49)	HSD11B1EBPACLYACACAPTPN11
SCHEMBL159792	0.85	EBP (0.47)	HSD11B1HMGCREBPACLYACACA
SCHEMBL568813	0.83	HSD11B1 (0.50)	HSD11B1EBPACLYACACAPTPN11
SCHEMBL377472	0.77	ACLY (0.38)	HSD11B1EBPACLYACACAPTPN11
SCHEMBL8026697	0.74	ACLY (0.39)	HSD11B1EBPACLYACACAPTPN11
Niacin SCHEMBL6684757	0.73	EBP (0.39)	HSD11B1HMGCREBPACLYACACA
SCHEMBL2257958	0.72	EBP (0.45)	HSD11B1HMGCREBPACLYACACA
Lanosterol SCHEMBL14698336	0.72	MAPT (0.62)	HMGCRACLYACACA
SCHEMBL1874653	0.72	ACLY (0.48)	HSD11B1EBPACLYACACAPTPN11

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
US-4748161-A	Triterpenyl esters of organic acids and hypolipidemic agents composed of them	AMANO PHARMACEUTICAL CO., LTD. (JP)	1988-05-31	—	—	US	disclosed