SCHEMBL6903969

SCHEMBL6903969

CCCCCCCCCCCCC(C)OCC(C)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.52
MAPT P10636 2/20 0.47
SPHK1 Q9NYA1 2/20 0.45
FAAH O00519 5/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
GPR84 Q9NQS5 5/20 0.41
FFAR1 O14842 1/20 0.41
LMNA P02545 2/20 0.40
HSD17B10 Q99714 1/20 0.40
CYP2D6 P10635 2/20 0.38
GMNN O75496 1/20 0.38
POLB P06746 1/20 0.38
THPO P40225 1/20 0.38
MTOR P42345 1/20 0.38
BLM P54132 1/20 0.38
KDM4E B2RXH2 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL26270570 1.00 TDP1 (0.52) TDP1MAPTSPHK1FAAHCNR1
SCHEMBL31680382 0.98 TDP1 (0.53) TDP1MAPTSPHK1FAAHCNR1
SCHEMBL2266461 0.94 TDP1 (0.55) TDP1MAPTSPHK1FAAHCNR1
SCHEMBL2268828 0.94 TDP1 (0.55) TDP1MAPTSPHK1FAAHCNR1
SCHEMBL2266778 0.94 TDP1 (0.55) TDP1MAPTSPHK1FAAHCNR1
SCHEMBL7941774 0.91 TDP1 (0.55) TDP1MAPTSPHK1FAAHCNR1
SCHEMBL7940951 0.88 TDP1 (0.57) TDP1MAPTSPHK1FAAHCNR1
SCHEMBL7943965 0.88 TDP1 (0.57) TDP1MAPTSPHK1FAAHCNR1
SCHEMBL6420891 0.86 GPR84 (0.46) SPHK1FAAHCNR1CNR2GPR84
SCHEMBL29259717 0.86 GPR84 (0.46) SPHK1FAAHCNR1CNR2GPR84

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
EP-1237408-B1 POUR-ON FORMULATIONS LILLY CO ELI (US) 2004-02-18 EP claimed