SCHEMBL7657426

SCHEMBL7657426

CC(C)(C)OC(=O)N1CCN(C(C(=O)OCc2ccccc2)C2CCNCC2)C(=O)C1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
GPR119 Q8TDV5 1/20 0.42
KLK7 P49862 1/20 0.42
MAPT P10636 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPK1 P28482 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
NTSR1 P30989 1/20 0.41
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
PARP1 P09874 1/20 0.40
STS P08842 1/20 0.39
YAP1 P46937 1/20 0.39
BACE1 P56817 1/20 0.39
P2RX7 Q99572 2/20 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
SCHEMBL4385892 0.93 SMN1; SMN2 (0.42) GPR119KLK7MEN1KMT2ANPSR1
SCHEMBL15110164 0.81 MEN1 (0.51) L3MBTL1GPR119MAPTMEN1KMT2A
SCHEMBL23343000 0.79 L3MBTL1 (0.44) L3MBTL1GPR119KLK7MAPTMEN1
SCHEMBL25426557 0.77 SMN1; SMN2 (0.45) L3MBTL1MEN1KMT2APARP1STS
SCHEMBL6894705 0.76 HTT (0.52) L3MBTL1GPR119MAPTMEN1KMT2A
SCHEMBL6580060 0.74 KCNA3 (0.47) L3MBTL1MAPTMEN1KMT2AMAPK1
SCHEMBL17736 0.74 MEN1 (0.49) L3MBTL1MEN1KMT2AMAPK1NPSR1
SCHEMBL24326113 0.73 MEN1 (0.51) MEN1KMT2AMAPK1NPSR1PARP1
SCHEMBL23343010 0.73 USP30 (0.48) L3MBTL1GPR119KLK7MAPTMEN1
SCHEMBL23342998 0.73 USP30 (0.48) L3MBTL1GPR119KLK7MAPTMEN1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6335341-B1 ANTICHOLESTEROL AGENTS; ATHEROSCLEROSIS ZENECA LIMITED (GB) 2002-01-01 US disclosed
EP-1000057-A1 PYRIDYL- AND PYRIMIDYL-HETEROCYCLIC COMPOUNDS INHIBITING OXIDO SQUALENE-CYCLASE AstraZeneca UK Limited (GB) 2000-05-17 EP disclosed
WO-1999006395-A1 PYRIDYL- AND PYRIMIDYL-HETEROCYCLIC COMPOUNDS INHIBITING OXIDO SQUALENE-CYCLASE ZENECA LIMITED (GB) 1999-02-11 WO disclosed