SCHEMBL9753331

SCHEMBL9753331

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

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MME P08473 10/20 0.37
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
F7 P08709 1/20 0.32
CTSK P43235 3/20 0.31
MFN2 O95140 1/20 0.31
SYK P43405 1/20 0.30
CTSS P25774 1/20 0.30
KLK5 Q9Y337 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
SCHEMBL9753327 1.00 MME (0.37) MMEKMT2AL3MBTL1F7CTSK
SCHEMBL9752737 0.87 MME (0.42) MMEKMT2AL3MBTL1MFN2
SCHEMBL9753244 0.85 MME (0.40) MMEKMT2AL3MBTL1MFN2
SCHEMBL9753166 0.81 MME (0.38) MMEMFN2
SCHEMBL9753159 0.76 MME (0.42) MMEMFN2
SCHEMBL9753161 0.76 MME (0.42) MMEMFN2
SCHEMBL9752738 0.75 MFN2 (0.34) MMEKMT2AL3MBTL1F7CTSK
SCHEMBL9753167 0.74 KMT2A (0.36) KMT2AL3MBTL1F7CTSKCTSS
SCHEMBL7295956 0.72 MME (0.43) MMEL3MBTL1
SCHEMBL7295964 0.72 MME (0.43) MMEL3MBTL1

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