SCHEMBL7759657

SCHEMBL7759657

[CH2]OC(=O)c1ccc(OC(=O)CNC(=O)OCc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.55
MAPT P10636 4/20 0.51
ALDH1A1 P00352 2/20 0.51
GAA P10253 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KMT2A Q03164 2/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A3 Q01959 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
RAB9A P51151 1/20 0.45
HTT P42858 1/20 0.44
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
TPSAB1 Q15661 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
SCHEMBL11589991 0.89 MAPT (0.57) ATMMAPTALDH1A1GAAL3MBTL1
SCHEMBL7758173 0.87 ATM (0.60) ATMMAPTALDH1A1GAAL3MBTL1
SCHEMBL7758148 0.87 ATM (0.54) ATMMAPTALDH1A1GAAL3MBTL1
SCHEMBL7176512 0.86 ATM (0.62) ATMMAPTALDH1A1GAAL3MBTL1
SCHEMBL10915714 0.84 ATM (0.62) ATMMAPTALDH1A1GAAL3MBTL1
SCHEMBL7758133 0.81 KDM1A (0.59) MAPTALDH1A1GAALMNAKMT2A
SCHEMBL11027505 0.79 ATM (0.56) ATMMAPTALDH1A1GAAL3MBTL1
SCHEMBL11511321 0.79 ATM (0.71) ATMMAPTALDH1A1L3MBTL1LMNA
SCHEMBL1803004 0.78 ATM (0.55) ATMMAPTALDH1A1GAARAB9A
SCHEMBL7423516 0.77 ELANE (0.43) MAPTALDH1A1GAALMNASMN1; SMN2

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
WO-2001062242-A1 PRODRUGS OF SUBSTITUTED CYCLOPENTANE AND CYCLOPENTENE COMPOUNDS USEFUL AS NEURAMINIDASE INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2001-08-30 WO disclosed