SCHEMBL9535223

SCHEMBL9535223

CCOc1ncccc1COC(C)=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.51
SLC13A5 Q86YT5 2/20 0.50
MAPK1 P28482 2/20 0.48
LMNA P02545 4/20 0.46
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 2/20 0.46
MAPT P10636 1/20 0.46
TSHR P16473 2/20 0.43
KMT2A Q03164 2/20 0.43
ATM Q13315 1/20 0.43
NPC1 O15118 2/20 0.43
POLB P06746 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL28437452 0.86 L3MBTL1 (0.50) L3MBTL1SLC13A5MAPK1LMNAALDH1A1
SCHEMBL12948866 0.79 SLC13A5 (0.52) L3MBTL1SLC13A5MAPK1LMNAALDH1A1
SCHEMBL10752180 0.78 ALDH1A1 (0.49) L3MBTL1ALDH1A1HTTMAPTTSHR
SCHEMBL24107506 0.78 ALDH1A1 (0.44) L3MBTL1ALDH1A1SMN1; SMN2HTTMAPT
SCHEMBL3418880 0.76 KMT2A (0.58) L3MBTL1SLC13A5MAPK1LMNAALDH1A1
SCHEMBL13034142 0.76 L3MBTL1 (0.54) L3MBTL1LMNAALDH1A1MAPTTSHR
SCHEMBL21155351 0.75 ALDH1A1 (0.42) L3MBTL1MAPK1LMNAALDH1A1SMN1; SMN2
SCHEMBL27486669 0.75 MEN1 (0.51) L3MBTL1LMNAALDH1A1SMN1; SMN2HTT
SCHEMBL9828121 0.75 MEN1 (0.47) L3MBTL1LMNAALDH1A1SMN1; SMN2HTT
SCHEMBL4067440 0.75 MAPT (0.46) MAPK1LMNAALDH1A1SMN1; SMN2HTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0382629-B1 Aminoalkoxyphenyl derivatives, process for their preparation and compositions containing them SANOFI ELF (FR) 1993-11-24 EP disclosed
EP-0382629-A1 Aminoalkoxyphenyl derivatives, process for their preparation and compositions containing them ELF SANOFI (FR) 1990-08-16 EP disclosed