SCHEMBL10564366

SCHEMBL10564366

OCC(O)C(O)CCCCCCCCCCCCCCCCCC(O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
CYP2D6 P10635 2/20 0.41
SPHK1 Q9NYA1 2/20 0.41
CYP3A4 P08684 2/20 0.41
GMNN O75496 1/20 0.41
POLB P06746 1/20 0.41
THPO P40225 1/20 0.41
MTOR P42345 1/20 0.41
BLM P54132 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
MAPT P10636 1/20 0.41
CETP P11597 1/20 0.41
HTT P42858 1/20 0.41
UBE2N P61088 1/20 0.41
TRPV1 Q8NER1 1/20 0.40
TRPA1 O75762 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL15404584 0.92 LMNA (0.40) LMNACYP2D6SPHK1CYP3A4GMNN
SCHEMBL2985499 0.83 LMNA (0.41) LMNACYP2D6SPHK1CYP3A4GMNN
SCHEMBL6448213 0.83 LMNA (0.41) LMNACYP2D6SPHK1CYP3A4GMNN
SCHEMBL3168782 0.83 LMNA (0.41) LMNACYP2D6SPHK1CYP3A4GMNN
SCHEMBL891846 0.83 LMNA (0.41) LMNACYP2D6SPHK1CYP3A4GMNN
SCHEMBL151903 0.80 LMNA (0.40) LMNACYP2D6SPHK1CYP3A4GMNN
SCHEMBL474272 0.79 LMNA (0.44) LMNAKDM4EL3MBTL1TDP1
SCHEMBL25243382 0.79 LMNA (0.65) LMNACYP2D6SPHK1CYP3A4GMNN
SCHEMBL1964037 0.79 LMNA (0.65) LMNACYP2D6SPHK1CYP3A4GMNN
SCHEMBL918858 0.79 LMNA (0.65) LMNACYP2D6SPHK1CYP3A4GMNN

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-4851450-A GLYCEROLS MONOETHERIFIED WITH VICINAL DIHYDROXYALKYL OR DIACETOXYALKYL DEMOPOULOS CONSTANTINE A (GR) 1989-07-25 US disclosed