SCHEMBL2836699

SCHEMBL2836699

CCCCCCCCCCCCCCCCOCC(COCCCCCCCCCCCCCCCC)NC(=O)OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLA2G2C Q5R387 9/20 0.57
CTSK P43235 4/20 0.45
CTSS P25774 1/20 0.43
USP2 O75604 1/20 0.42
HTT P42858 1/20 0.41
CES2 O00748 1/20 0.41

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
SCHEMBL24485595 1.00 PLA2G2C (0.57) PLA2G2CCTSKCTSSUSP2HTT
SCHEMBL16774850 0.94 PLA2G2C (0.49) PLA2G2CCTSKCTSS
SCHEMBL16638806 0.90 PLA2G2C (0.46) PLA2G2CCTSKCTSS
SCHEMBL8298404 0.87 PLA2G2C (0.48) PLA2G2CCTSKCTSS
SCHEMBL13942942 0.87 PLA2G2C (0.48) PLA2G2CCTSKCTSS
SCHEMBL26048947 0.85 CTSK (0.48) PLA2G2CCTSKCTSS
SCHEMBL19014799 0.83 CTSK (0.47) PLA2G2CCTSKCTSS
SCHEMBL31407501 0.82 PPARA (0.52) PLA2G2CCTSKCTSSUSP2
SCHEMBL12629370 0.82 PLA2G2C (0.62) PLA2G2CCTSKCTSS
SCHEMBL28854983 0.82 CTSK (0.46) PLA2G2CCTSKCTSSUSP2HTT

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100104629-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2010-04-29 US disclosed
US-20100099738-A1 POLYETHYLENE GLYCOL LIPID CONJUGATES AND USES THEREOF ABBOTT LABORATORIES (US) 2010-04-22 US disclosed
US-20100076055-A1 Cationic Lipids and Uses Thereof ABBOTT LABORATORIES (US) 2010-03-25 US disclosed
WO-2010030730-A1 POLYETHYLENE GLYCOL LIPID CONJUGATES AND USES THEREOF ABBOTT LABORATORIES (US) 2010-03-18 WO disclosed
US-20100055168-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2010-03-04 US disclosed
US-20100055169-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2010-03-04 US disclosed
US-20090285881-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-11-19 US disclosed
WO-2009129385-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed
WO-2009129387-A2 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed
WO-2009129395-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100099738-A1 POLYETHYLENE GLYCOL LIPID CONJUGATES AND USES THEREOF LIPA, LIPG, LIPC PLA2G2C 1860/4885CTSK 1962/4885CTSS 2337/4885
US-20100104629-A1 CATIONIC LIPIDS AND USES THEREOF LIPA, SGMS2, SGMS1 PLA2G2C 252/4885CTSK 747/4885CTSS 482/4885
US-20100076055-A1 Cationic Lipids and Uses Thereof LIPA, SGMS2, SGMS1 PLA2G2C 252/4885CTSK 747/4885CTSS 482/4885
US-20090285881-A1 CATIONIC LIPIDS AND USES THEREOF LIPA, SGMS2, SGMS1 PLA2G2C 252/4885CTSK 747/4885CTSS 482/4885
US-20100055168-A1 CATIONIC LIPIDS AND USES THEREOF LIPA, SGMS2, SGMS1 PLA2G2C 252/4885CTSK 747/4885CTSS 482/4885
US-20100055169-A1 CATIONIC LIPIDS AND USES THEREOF LIPA, SGMS2, SGMS1 PLA2G2C 252/4885CTSK 747/4885CTSS 482/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.