SCHEMBL2052046

SCHEMBL2052046

CO/N=C(\C)C/C(=N\OC)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
GSK3B P49841 1/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ATM Q13315 1/20 0.42
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
DRD4 P21917 2/20 0.40
DRD2 P14416 1/20 0.40
TSHR P16473 1/20 0.39
SLC6A4 P31645 1/20 0.38
FFAR1 O14842 2/20 0.37
PPARA Q07869 1/20 0.37

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
SCHEMBL2052047 1.00 MAPT (0.45) MAPTGSK3BLMNAMAPK1HTT
SCHEMBL2050545 0.84 MAPT (0.51) MAPTGSK3BLMNAMAPK1HTT
SCHEMBL2050546 0.84 MAPT (0.51) MAPTGSK3BLMNAMAPK1HTT
SCHEMBL2043138 0.83 GSK3B (0.44) MAPTGSK3BLMNAMAPK1HTT
SCHEMBL2043140 0.83 GSK3B (0.44) MAPTGSK3BLMNAMAPK1HTT
SCHEMBL8017835 0.81 TSHR (0.48) MAPTGSK3BMAPK1L3MBTL1ATM
SCHEMBL8017837 0.81 TSHR (0.48) MAPTGSK3BMAPK1L3MBTL1ATM
SCHEMBL2046346 0.80 DRD4 (0.50) MAPTGSK3BLMNAMAPK1HTT
SCHEMBL2046347 0.80 DRD4 (0.50) MAPTGSK3BLMNAMAPK1HTT
SCHEMBL9898920 0.80 KMT2A (0.55) MAPTGSK3BLMNAMAPK1KMT2A

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-20110152449-A1 POLYMERS FUNCTIONALIZED WITH POLYOXIME COMPOUNDS AND METHODS FOR THEIR MANUFACTURE BRIDGESTONE CORPORATION (JP) 2011-06-23 US claimed
US-8338544-B2 Polymers functionalized with polyoxime compounds and methods for their manufacture BRIDGESTONE CORPORATION (JP) 2012-12-25 US disclosed
US-20110152449-A1 POLYMERS FUNCTIONALIZED WITH POLYOXIME COMPOUNDS AND METHODS FOR THEIR MANUFACTURE BRIDGESTONE CORPORATION (JP) 2011-06-23 US disclosed