SCHEMBL30876512

SCHEMBL30876512

CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H](O)CO

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.45
ALDH1A1 P00352 4/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
TSHR P16473 1/20 0.41
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAPT P10636 1/20 0.39

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL29135004 1.00 HSD17B10 (0.45) HSD17B10ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL29199941 1.00 HSD17B10 (0.45) HSD17B10ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL30876511 1.00 HSD17B10 (0.45) HSD17B10ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL30341137 1.00 HSD17B10 (0.45) HSD17B10ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL29181926 1.00 HSD17B10 (0.45) HSD17B10ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL29135000 1.00 HSD17B10 (0.45) HSD17B10ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL30341139 1.00 HSD17B10 (0.45) HSD17B10ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL29199977 1.00 HSD17B10 (0.45) HSD17B10ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL29199944 1.00 HSD17B10 (0.45) HSD17B10ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL23545835 0.88 HSD17B10 (0.45) HSD17B10ALDH1A1MEN1KMT2AL3MBTL1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117957231-A Fused ring compound, preparation method and application thereof 上海艾力斯医药科技股份有限公司 2024-04-30 CN disclosed