SCHEMBL21283434

SCHEMBL21283434

CCCCCC(=O)O[C@H](C)CCOC(=O)[C@@H](N)CC(C)C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.46
▸ ALDH1A1 P00352 1/20 0.42
▸ FAAH O00519 4/20 0.42
▸ CNR1 P21554 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ DGKA P23743 1/20 0.41
▸ TLR2 O60603 1/20 0.41
▸ MAPT P10636 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ EPHX2 P34913 1/20 0.40
▸ PRKCA P17252 1/20 0.40
▸ PRKCE Q02156 1/20 0.40
▸ PRKCQ Q04759 1/20 0.40
▸ PRKCD Q05655 1/20 0.40

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
SCHEMBL21283433 0.86 SLC7A5 (0.38) FAAHCNR1CNR2TLR2
SCHEMBL21266960 0.82 DGKA (0.61) LMNAALDH1A1FAAHCNR1CNR2
SCHEMBL22829585 0.81 DGKA (0.65) LMNAALDH1A1FAAHCNR1CNR2
SCHEMBL3881797 0.81 DGKA (0.65) LMNAALDH1A1FAAHCNR1CNR2
SCHEMBL10052750 0.81 DGKA (0.65) LMNAALDH1A1FAAHCNR1CNR2
SCHEMBL23159109 0.81 DGKA (0.65) LMNAALDH1A1FAAHCNR1CNR2
SCHEMBL3880733 0.81 DGKA (0.65) LMNAALDH1A1FAAHCNR1CNR2
SCHEMBL21267047 0.81 DGKA (0.65) LMNAALDH1A1FAAHCNR1CNR2
SCHEMBL3871417 0.81 DGKA (0.65) LMNAALDH1A1FAAHCNR1CNR2
SCHEMBL3876127 0.81 DGKA (0.65) LMNAALDH1A1FAAHCNR1CNR2

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-2019161047-A1 ORAL SUPPLEMENTS OF FATTY ACID AND AMINO ACID KETONE ESTERS TO IMPROVE METABOLIC, PHYSICAL AND COGNITIVE HEALTH BICKMAN BENJAMIN (US) 2019-08-22 — — WO disclosed
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