SCHEMBL18015128

SCHEMBL18015128

CC(C)(C)OC(=O)N1CCCCC1COC(F)F

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE8B O95263 1/20 0.43
ALOX5AP P20292 1/20 0.42
FEN1 P39748 1/20 0.42
KDM1A O60341 1/20 0.41
ATM Q13315 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
EPHX1 P07099 1/20 0.37
TSHR P16473 1/20 0.37
PREP P48147 1/20 0.37

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
SCHEMBL19779316 1.00 PDE8B (0.43) PDE8BALOX5APFEN1KDM1AATM
SCHEMBL18015127 1.00 PDE8B (0.43) PDE8BALOX5APFEN1KDM1AATM
SCHEMBL18015118 0.96 ALOX5AP (0.45) PDE8BALOX5APFEN1ATMALDH1A1
SCHEMBL18015133 0.96 ALOX5AP (0.45) PDE8BALOX5APFEN1ATMALDH1A1
SCHEMBL18015115 0.96 ALOX5AP (0.45) PDE8BALOX5APFEN1ATMALDH1A1
SCHEMBL19768833 0.91 PDE8B (0.42) PDE8BALOX5APFEN1KDM1AATM
SCHEMBL19768838 0.91 PDE8B (0.42) PDE8BALOX5APFEN1KDM1AATM
SCHEMBL18015116 0.90 ALOX5AP (0.38) ALOX5APFEN1ATMALDH1A1HSD17B10
SCHEMBL24760647 0.85 HPGD (0.44) PDE8BALOX5APFEN1KDM1AATM
SCHEMBL18015119 0.84 ATM (0.43) PDE8BALOX5APFEN1ATMALDH1A1

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-2016123707-A1 PROCESS FOR THE SYNTHESIS OF DIFLUOROMETHYL ETHER-BASED COMPOUNDS TRILLIUM THERAPEUTICS INC. (CA) 2016-08-11 WO disclosed