SCHEMBL9296495

SCHEMBL9296495

CCCCCC(CCCC)OCC(C)OCC(C)O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
MAPT P10636 2/20 0.39
GPR84 Q9NQS5 3/20 0.36
SPHK1 Q9NYA1 1/20 0.36
FFAR1 O14842 1/20 0.36
HSD17B10 Q99714 1/20 0.35
OPRM1 P35372 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
CA1 P00915 2/20 0.32
FAAH O00519 2/20 0.32
TP53 P04637 1/20 0.32
LCK P06239 1/20 0.32
PPARD Q03181 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.32
ZDHHC2 Q9UIJ5 1/20 0.32
LMNA P02545 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 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
SCHEMBL9296222 0.93 MAPT (0.43) TDP1MAPTGPR84SPHK1FFAR1
SCHEMBL17888498 0.91 TDP1 (0.49) TDP1MAPTGPR84SPHK1FFAR1
SCHEMBL11613930 0.91 MAPT (0.46) TDP1MAPTGPR84SPHK1FFAR1
SCHEMBL25004972 0.89 MAPT (0.47) TDP1MAPTGPR84SPHK1FFAR1
SCHEMBL10657309 0.89 MAPT (0.47) TDP1MAPTGPR84SPHK1FFAR1
SCHEMBL6680325 0.89 MAPT (0.47) TDP1MAPTGPR84SPHK1FFAR1
SCHEMBL2268828 0.87 TDP1 (0.55) TDP1MAPTGPR84SPHK1FFAR1
SCHEMBL2266778 0.87 TDP1 (0.55) TDP1MAPTGPR84SPHK1FFAR1
SCHEMBL2266461 0.87 TDP1 (0.55) TDP1MAPTGPR84SPHK1FFAR1
SCHEMBL6680035 0.85 MAPT (0.44) TDP1MAPTGPR84SPHK1FFAR1

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
US-5352557-A Ether compound as carrier liquid FUJI XEROX CO., LTD. (JP) 1994-10-04 US disclosed