SCHEMBL8766562

SCHEMBL8766562

CSc1ccc(CN2CCC2=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
SMN1; SMN2 Q16637 8/20 0.48
ATM Q13315 2/20 0.48
KDM4E B2RXH2 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
HRH3 Q9Y5N1 1/20 0.46
LMNA P02545 2/20 0.46
RAB9A P51151 2/20 0.46
MAPT P10636 1/20 0.46
ALDH1A1 P00352 3/20 0.44
MAPK1 P28482 2/20 0.44
TNF P01375 2/20 0.44
NPC1 O15118 1/20 0.43
NR2F2 P24468 1/20 0.43
ACACB O00763 1/20 0.43
GAA P10253 1/20 0.41
NOD2 Q9HC29 1/20 0.41
NOD1 Q9Y239 1/20 0.41
POLB P06746 1/20 0.40

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
SCHEMBL28801601 0.77 ALDH1A1 (0.61) L3MBTL1SMN1; SMN2MEN1KMT2AHRH3
SCHEMBL11432095 0.76 GAA (0.68) L3MBTL1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7389188 0.76 L3MBTL1 (0.73) L3MBTL1MEN1KMT2AHRH3RAB9A
SCHEMBL8767909 0.75 L3MBTL1 (0.49) L3MBTL1SMN1; SMN2HRH3LMNAACACB
SCHEMBL8766644 0.74 HAO1 (0.43) SMN1; SMN2ATMKDM4EMEN1KMT2A
SCHEMBL3084212 0.74 ALDH1A1 (0.53) L3MBTL1SMN1; SMN2ATMKDM4EMEN1
SCHEMBL11200681 0.74 L3MBTL1 (0.76) L3MBTL1SMN1; SMN2KMT2AHRH3MAPK1
SCHEMBL13534477 0.70 L3MBTL1 (0.70) L3MBTL1SMN1; SMN2MEN1KMT2AHRH3
SCHEMBL12947867 0.70 L3MBTL1 (0.70) L3MBTL1SMN1; SMN2MEN1KMT2AHRH3
SCHEMBL13215733 0.70 L3MBTL1 (0.65) L3MBTL1SMN1; SMN2KMT2AHRH3LMNA

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