SCHEMBL8729385

SCHEMBL8729385

CCCCCCCCCCC(COCC(C)O)OCC(C)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.45
MAPT P10636 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
GPR84 Q9NQS5 4/20 0.41
SPHK1 Q9NYA1 3/20 0.41
FFAR1 O14842 1/20 0.41
USP2 O75604 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
HTT P42858 1/20 0.37
LMNA P02545 2/20 0.36
LCK P06239 1/20 0.36
PPARD Q03181 1/20 0.36
ZDHHC20 Q5W0Z9 1/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.36
GMNN O75496 1/20 0.35
POLB P06746 1/20 0.35
CYP2D6 P10635 1/20 0.35
THPO P40225 1/20 0.35
MTOR P42345 1/20 0.35
BLM P54132 1/20 0.35

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
SCHEMBL10657309 0.90 MAPT (0.47) HSD17B10MAPTTDP1GPR84SPHK1
SCHEMBL25004972 0.90 MAPT (0.47) HSD17B10MAPTTDP1GPR84SPHK1
SCHEMBL6680325 0.90 MAPT (0.47) HSD17B10MAPTTDP1GPR84SPHK1
SCHEMBL11613930 0.89 MAPT (0.46) HSD17B10MAPTTDP1GPR84SPHK1
SCHEMBL6680035 0.87 MAPT (0.44) HSD17B10MAPTTDP1GPR84SPHK1
SCHEMBL2422502 0.87 MAPT (0.44) HSD17B10MAPTTDP1GPR84SPHK1
SCHEMBL4511080 0.87 MAPT (0.44) HSD17B10MAPTTDP1GPR84SPHK1
SCHEMBL9296222 0.86 MAPT (0.43) HSD17B10MAPTTDP1GPR84SPHK1
SCHEMBL26555068 0.86 USP2 (0.49) HSD17B10MAPTTDP1SPHK1USP2
SCHEMBL8520740 0.85 MAPT (0.42) HSD17B10MAPTTDP1GPR84SPHK1

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
EP-0614918-B1 Polymerizable compositions and in-mold cured products using same TAKEMOTO OIL & FAT CO LTD (JP) 1998-10-21 EP disclosed
EP-0614918-A1 Polymerizable compositions and in-mold cured products using same Takemoto Yushi Kabushiki Kaisha (JP) 1994-09-14 EP disclosed