SCHEMBL9753245

SCHEMBL9753245

CCOC(=O)C1CCC(NC(=O)C2(C(CC(=O)OC(C)(C)C)CN(CCc3ccccc3)CCc3ccccc3)CCCC2)CC1CCc1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.32
MFN2 O95140 1/20 0.32
KMT2A Q03164 1/20 0.31
F7 P08709 1/20 0.31
RECQL P46063 1/20 0.31
OPRM1 P35372 1/20 0.30
TP53 P04637 1/20 0.30
ALOX5 P09917 1/20 0.30

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
SCHEMBL9752738 0.90 MFN2 (0.34) L3MBTL1MFN2KMT2AF7RECQL
SCHEMBL9753244 0.84 MME (0.40) L3MBTL1MFN2KMT2AOPRM1
SCHEMBL9753167 0.84 KMT2A (0.36) L3MBTL1KMT2AF7
SCHEMBL9752737 0.77 MME (0.42) L3MBTL1MFN2KMT2A
SCHEMBL9753166 0.73 MME (0.38) MFN2
SCHEMBL9753327 0.71 MME (0.37) L3MBTL1MFN2KMT2AF7
SCHEMBL9753331 0.71 MME (0.37) L3MBTL1MFN2KMT2AF7
SCHEMBL9753159 0.68 MME (0.42) MFN2
SCHEMBL9753161 0.68 MME (0.42) MFN2
SCHEMBL9753427 0.68 MFN2 (0.42) MFN2KMT2A

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
WO-1991007378-A1 CYCLOALKYL-SUBSTITUTED GLUTARAMIDE DIURETIC AGENTS PFIZER LIMITED (GB) 1991-05-30 WO disclosed