SCHEMBL8088815

SCHEMBL8088815

CC(COC(=O)CCS)OC(=O)CCS.O=C(CCS)OCCCOC(=O)CCS

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.37
PRKCA P17252 1/20 0.36
PRKCE Q02156 1/20 0.36
PRKCQ Q04759 1/20 0.36
PRKCD Q05655 1/20 0.36
DGKA P23743 1/20 0.34
LPAR3 Q9UBY5 3/20 0.33
LPAR1 Q92633 2/20 0.33
ENPP2 Q13822 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ACE P12821 1/20 0.33
DNM1 Q05193 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL98334 0.91 LMNA (0.41) LMNAALDH1A1MAPTPRKCAPRKCE
Ethylene Glycol SCHEMBL2127403 0.86 PRKCA (0.38) LMNAALDH1A1MAPTPRKCAPRKCE
SCHEMBL97076 0.85 LMNA (0.37) LMNAALDH1A1MAPTPRKCAPRKCE
SCHEMBL31454173 0.85 LMNA (0.37) LMNAALDH1A1MAPTPRKCAPRKCE
SCHEMBL98009 0.85 LMNA (0.37) LMNAALDH1A1MAPTPRKCAPRKCE
SCHEMBL6679314 0.84 LMNA (0.44) LMNAALDH1A1MAPTPRKCAPRKCE
SCHEMBL3086359 0.84 LMNA (0.46) LMNAALDH1A1MAPTPRKCAPRKCE
SCHEMBL31576079 0.83 LMNA (0.49) LMNAALDH1A1MAPTPRKCAPRKCE
SCHEMBL170421 0.81 ADRA2A (0.35) LMNAALDH1A1MAPTDGKAACE
SCHEMBL99058 0.80 DGKA (0.43) ALDH1A1MAPTDGKASMN1; SMN2ACE

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-1046078-A1 LIQUID CRYSTAL DEVICE ALIGNMENT Hewlett-Packard Company (US) 2000-10-25 EP disclosed
WO-1999018474-A1 LIQUID CRYSTAL DEVICE ALIGNMENT HEWLETT-PACKARD COMPANY (US) 1999-04-15 WO disclosed