SCHEMBL6842695

SCHEMBL6842695

CCCOC1CCCCN1C(=O)OCC

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
THRB P10828 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
FKBP1A P62942 2/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 2/20 0.39
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 3/20 0.37
MAPK1 P28482 3/20 0.37
KMT2A Q03164 3/20 0.37
HTT P42858 1/20 0.37
CASP6 P55212 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HCRTR2 O43614 1/20 0.36
NOS3 P29474 1/20 0.36
NOS2 P35228 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL25759294 0.89 ALDH1A1 (0.49) ALDH1A1THRBATML3MBTL1FKBP1A
SCHEMBL28206939 0.83 GAA (0.35) ALDH1A1FKBP1AGAAKMT2ARAB9A
SCHEMBL27895475 0.82 ALDH1A1 (0.49) ALDH1A1THRBATML3MBTL1FKBP1A
Hydrochloric Acid SCHEMBL28206992 0.81 ALDH1A1 (0.47) ALDH1A1THRBATML3MBTL1FKBP1A
SCHEMBL11560770 0.79 FKBP1A (0.37) ALDH1A1THRBATML3MBTL1FKBP1A
SCHEMBL6843660 0.79 TAAR1 (0.40) ALDH1A1L3MBTL1KDM4EPOLBRAB9A
SCHEMBL27589985 0.78 RAB9A (0.56) ALDH1A1THRBATML3MBTL1FKBP1A
SCHEMBL14407834 0.76 NAAA (0.42) L3MBTL1MEN1KMT2A
SCHEMBL11563078 0.75 CHRM2 (0.39) ALDH1A1L3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL6842725 0.75 L3MBTL1 (0.41) ALDH1A1L3MBTL1POLBMEN1KMT2A

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-20040094407-A1 Spatially addressable electrolysis platform and methods of use YUDIN ANDREI K (CA) 2004-05-20 US disclosed
EP-1292388-A2 SPATIALLY ADDRESSABLE ELECTROLYSIS PLATFORM AND METHODS OF USE 1428388 Ontario Limited (CA) 2003-03-19 EP disclosed
WO-2001094666-A2 SPATIALLY ADDRESSABLE ELECTROLYSIS PLATFORM AND METHODS OF USE YLEKTRA INC. (CA) 2001-12-13 WO disclosed