SCHEMBL8019342

SCHEMBL8019342

CN(CCO)N1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
SLC29A1 Q99808 1/20 0.38
MAPT P10636 2/20 0.35
POLB P06746 3/20 0.33
GAA P10253 1/20 0.33
MGLL Q99685 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
FAAH O00519 1/20 0.31
PHGDH O43175 1/20 0.31
ALDH2 P05091 1/20 0.31
PDK1 Q15118 1/20 0.31
PDK2 Q15119 1/20 0.31
PDK3 Q15120 1/20 0.31
USP2 O75604 1/20 0.31
HTT P42858 1/20 0.31
TSHR P16473 1/20 0.31
MLYCD O95822 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL4724117 0.80 SMN1; SMN2 (0.34) ALDH1A1MAPTPOLBGAASMN1; SMN2
SCHEMBL27989623 0.77 MAPT (0.38) ALDH1A1KDM4ESLC29A1MAPTGAA
SCHEMBL4723915 0.77 LMNA (0.40) ALDH1A1KDM4EMAPTPOLBSMN1; SMN2
SCHEMBL14530926 0.75 PRMT1 (0.39)
SCHEMBL4724222 0.75 SMN1; SMN2 (0.37) ALDH1A1KDM4EMAPTPOLBGAA
SCHEMBL27989613 0.74 MAPT (0.35) MAPT
Dimethylaminoethanol SCHEMBL11313600 0.72 MAPT (0.50) ALDH1A1KDM4ESLC29A1MAPTGAA
Bromide SCHEMBL28502550 0.72 DNM1 (0.43) ALDH1A1POLBSMN1; SMN2USP2HTT
Iodide SCHEMBL27860071 0.72 DNM1 (0.40) ALDH1A1POLBSMN1; SMN2USP2HTT
Bromide SCHEMBL28495073 0.72 DNM1 (0.43) ALDH1A1POLBSMN1; SMN2USP2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0972005-A4 PROCESS FOR MAKING TABLETTED DETERGENT COMPOSITIONS PROCTER & GAMBLE (US) 2000-12-27 EP disclosed
EP-1017782-A1 CLEANING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2000-07-12 EP disclosed
EP-0972005-A1 PROCESS FOR MAKING TABLETTED DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2000-01-19 EP disclosed
WO-1999014304-A1 CLEANING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1999-03-25 WO disclosed
WO-1998032834-A1 PROCESS FOR MAKING TABLETTED DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-07-30 WO disclosed