SCHEMBL24219795

SCHEMBL24219795

CCCCCCCCCCCCC(CCCOC(=O)CCCCC(COC(=O)CCCCCCC)COC(=O)CCCCCCC)OC(=O)C1CCCN1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 2/20 0.45
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PRCP P42785 2/20 0.41
PRKCA P17252 3/20 0.40
PRKCE Q02156 1/20 0.40
PRKCQ Q04759 1/20 0.40
PRKCD Q05655 1/20 0.40
DGKA P23743 1/20 0.39
EPHX2 P34913 1/20 0.39
DPP7 Q9UHL4 1/20 0.38
MAPT P10636 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
SCHEMBL16829874 1.00 TLR2 (0.45) TLR2ALDH1A1LMNACYP3A4TSHR
SCHEMBL16829892 0.83 TLR2 (0.48) TLR2ALDH1A1LMNAPRCPPRKCA
SCHEMBL16829890 0.83 TLR2 (0.48) TLR2ALDH1A1LMNAPRCPPRKCA
SCHEMBL26539681 0.83 TLR2 (0.47) TLR2ALDH1A1LMNAPRCPPRKCA
SCHEMBL21105823 0.83 PRCP (0.56) TLR2PRCPEPHX2DPP7
SCHEMBL26117166 0.80 ALDH1A1 (0.47) TLR2ALDH1A1LMNAPRKCAPRKCE
SCHEMBL19034641 0.79 PRCP (0.51) TLR2PRCPDPP7
SCHEMBL19230109 0.75 ALDH1A1 (0.43) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL16829753 0.73 CYP3A4 (0.59) ALDH1A1LMNACYP3A4TSHRATM
SCHEMBL8667292 0.73 ALDH1A1 (0.71) ALDH1A1LMNACYP3A4TSHRATM

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-3083579-B1 LIPIDS AND LIPID COMPOSITIONS FOR THE DELIVERY OF ACTIVE AGENTS NOVARTIS AG (CH) 2022-01-26 EP disclosed