Ether

Ether

SCHEMBL8518047

CCCCC(O)(O)OC(=O)O.CCOCC

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PAM P19021 2/20 0.32
FAAH O00519 3/20 0.31
CA2 P00918 1/20 0.31
MAPK1 P28482 1/20 0.31
AKR1B1 P15121 1/20 0.31
CES2 O00748 2/20 0.31
SMPD1 P17405 1/20 0.31
GPR84 Q9NQS5 2/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CES1 P23141 1/20 0.31

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
SCHEMBL5873986 0.92 AKR1B1 (0.36) PAMCA2MAPK1AKR1B1GPR84
SCHEMBL27981471 0.86 FDPS (0.42) AKR1B1CES2SMPD1GPR84
SCHEMBL11591443 0.79 FDPS (0.36) TDP1
SCHEMBL5873985 0.77 FDPS (0.35) CES2SMPD1KMT2AL3MBTL1CES1
SCHEMBL8518050 0.76 SMPD1 (0.37) PAMAKR1B1SMPD1KMT2ATDP1
SCHEMBL27688964 0.75 ALDH1A1 (0.43) CES2SMPD1KMT2AL3MBTL1CES1
SCHEMBL5480792 0.74 LMNA (0.31) PAM
SCHEMBL8089327 0.73 TSHR (0.50) MAPK1
SCHEMBL2702976 0.73 AKR1B1 (0.37) PAMAKR1B1GPR84KMT2ATDP1
Bicarbonate SCHEMBL8518052 0.73 AKR1B1 (0.37) PAMAKR1B1GPR84KMT2ATDP1

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
JP-11140177-A None JP disclosed
JP-H11140177-A ULTRAHIGH-MOLECULAR-WEIGHT AROMATIC POLYCARBONATE AND PRODUCTION OF AROMATIC POLYCARBONATE AGENCY OF IND SCIENCE & TECHNOL 1999-05-25 JP disclosed