SCHEMBL7304770

SCHEMBL7304770

CC(C)SCC(O)[C@@H]1CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPC1 O15118 1/20 0.39
TSHR P16473 1/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL28829166 0.85 HSD17B10 (0.45) ALDH1A1HSD17B10MEN1KMT2AL3MBTL1
SCHEMBL23545835 0.85 HSD17B10 (0.45) ALDH1A1HSD17B10MEN1KMT2AL3MBTL1
SCHEMBL30069139 0.85 HSD17B10 (0.45) ALDH1A1HSD17B10MEN1KMT2AL3MBTL1
SCHEMBL8894333 0.83 HSD17B10 (0.46) ALDH1A1HSD17B10MEN1KMT2AL3MBTL1
SCHEMBL29199977 0.82 HSD17B10 (0.45) ALDH1A1HSD17B10MEN1KMT2AL3MBTL1
SCHEMBL29199941 0.82 HSD17B10 (0.45) ALDH1A1HSD17B10MEN1KMT2AL3MBTL1
SCHEMBL30876511 0.82 HSD17B10 (0.45) ALDH1A1HSD17B10MEN1KMT2AL3MBTL1
SCHEMBL29135004 0.82 HSD17B10 (0.45) ALDH1A1HSD17B10MEN1KMT2AL3MBTL1
SCHEMBL30341137 0.82 HSD17B10 (0.45) ALDH1A1HSD17B10MEN1KMT2AL3MBTL1
SCHEMBL30876512 0.82 HSD17B10 (0.45) ALDH1A1HSD17B10MEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5506256-A PREVENTION AND/OR TREATMENT OF DEMENTIA, AMNESIA YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-04-09 US disclosed
EP-0468469-A2 Proline derivatives Japan Tobacco Inc. (JP) 1992-01-29 EP disclosed