SCHEMBL11290293

SCHEMBL11290293

CCCOCC(C)OCC(C)OCC(C)OC(=O)CC

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.58
HSD17B10 Q99714 1/20 0.42
NAAA Q02083 1/20 0.32
FAAH O00519 4/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30
LMNA P02545 2/20 0.30

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
SCHEMBL445697 0.93 TDP1 (0.50) TDP1HSD17B10NAAAFAAHCNR1
SCHEMBL18157282 0.87 NAAA (0.46) TDP1NAAAFAAHCNR1CNR2
SCHEMBL2700958 0.86 TDP1 (0.39) TDP1
SCHEMBL896812 0.84 TDP1 (0.59) TDP1HSD17B10
SCHEMBL487418 0.84 TDP1 (0.59) TDP1HSD17B10
SCHEMBL12971220 0.84 TDP1 (0.51) TDP1HSD17B10LMNA
SCHEMBL14962330 0.84 TDP1 (0.44) TDP1HSD17B10
SCHEMBL3019540 0.84 TDP1 (0.51) TDP1HSD17B10LMNA
SCHEMBL223952 0.84 TDP1 (0.36) TDP1NAAA
SCHEMBL443948 0.82 NAAA (0.41) TDP1HSD17B10NAAAFAAHCNR1

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
US-4322550-A HIGH-SPEED SOLVENT EXTRACTION FROM AN AQUEOUS SOLUTION PHILLIPS PETROLEUM COMPANY (US) 1982-03-30 US claimed
US-4322550-A HIGH-SPEED SOLVENT EXTRACTION FROM AN AQUEOUS SOLUTION PHILLIPS PETROLEUM COMPANY (US) 1982-03-30 US disclosed