SCHEMBL8766682

SCHEMBL8766682

CSC(c1ccccc1)C(CCN1CCC1=O)OO

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
ADRA1B P35368 1/20 0.39
L3MBTL1 Q9Y468 3/20 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
SCHEMBL8766975 0.76 ADRA1B (0.44) MEN1KMT2ANPC1RAB9AADRA1B
SCHEMBL8767658 0.68 NPC1 (0.44) MEN1KMT2ANPC1RAB9AL3MBTL1
SCHEMBL8766432 0.67 HTT (0.40) MEN1KMT2ANPC1RAB9AADRA1B
SCHEMBL8772464 0.67 KMT2A (0.45) MEN1KMT2ANPC1RAB9AADRA1B
SCHEMBL4314794 0.66 PKM (0.44) MEN1KMT2ANPC1RAB9AL3MBTL1
SCHEMBL4317705 0.66 PKM (0.44) MEN1KMT2ANPC1RAB9AL3MBTL1
SCHEMBL10875798 0.64 ADRA1B (0.61) MEN1KMT2ANPC1RAB9AADRA1B
SCHEMBL25015762 0.63 ADRA1B (0.53) MEN1KMT2AADRA1BL3MBTL1
SCHEMBL7083850 0.63 PKM (0.39) MEN1KMT2ANPC1RAB9A
SCHEMBL8772367 0.63 LMNA (0.43) MEN1KMT2AL3MBTL1

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
EP-0788478-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1997-08-13 EP claimed