SCHEMBL6746741

SCHEMBL6746741

O=C(NCCc1cccc2c(CCNC(=O)OCc3ccccc3)cccc12)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
HTT P42858 1/20 0.58
IDO1 P14902 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.54
TGM2 P21980 1/20 0.52
KEAP1 Q14145 2/20 0.51
NFE2L2 Q16236 2/20 0.51
MAPT P10636 1/20 0.50
NMBR P28336 1/20 0.50
GAA P10253 1/20 0.49
SLC1A3 P43003 1/20 0.49
SLC1A1 P43005 1/20 0.49
MTNR1A P48039 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
PLAU P00749 1/20 0.48

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
SCHEMBL4667297 0.85 LMNA (0.61) LMNASMN1; SMN2HTTIDO1L3MBTL1
SCHEMBL6563145 0.85 LMNA (0.46) LMNASMN1; SMN2HTTIDO1L3MBTL1
Benzyl Phenethylcarbamate SCHEMBL4287199 0.84 LMNA (0.73) LMNASMN1; SMN2HTTIDO1L3MBTL1
SCHEMBL535090 0.84 LMNA (0.60) LMNASMN1; SMN2HTTIDO1L3MBTL1
SCHEMBL29682187 0.84 LMNA (0.60) LMNASMN1; SMN2HTTIDO1L3MBTL1
SCHEMBL21848124 0.84 LMNA (0.60) LMNASMN1; SMN2HTTIDO1L3MBTL1
SCHEMBL6563148 0.82 LMNA (0.44) LMNASMN1; SMN2HTTIDO1L3MBTL1
SCHEMBL13055383 0.82 LMNA (0.80) LMNASMN1; SMN2HTTIDO1L3MBTL1
SCHEMBL9116981 0.81 NMBR (0.73) LMNASMN1; SMN2IDO1MAPTNMBR
SCHEMBL4667311 0.81 LMNA (0.56) LMNASMN1; SMN2HTTIDO1L3MBTL1

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
US-6703425-B2 ADMINISTERING GLUTAMATE RECEPTOR POTENTIATOR TO TREAT PSYCHOLOGICAL AND NERVOUS SYSTEM DISORDERS ELI LILLY AND COMPANY 2004-03-09 US disclosed