SCHEMBL4132454

SCHEMBL4132454

CCOC(=O)OCC1COC(C)(C)O1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.50
ALDH1A1 P00352 4/20 0.42
NPSR1 Q6W5P4 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
HTR7 P34969 1/20 0.37
TMEM97 Q5BJF2 2/20 0.36
SIGMAR1 Q99720 2/20 0.36
SOAT1 P35610 1/20 0.35
HSD17B10 Q99714 2/20 0.32
LMNA P02545 1/20 0.32
DGAT1 O75907 1/20 0.32
APP P05067 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL13651150 1.00 CA2 (0.50) CA2ALDH1A1NPSR1CTDSP1HTR7
SCHEMBL18395904 0.93 CA2 (0.56) CA2ALDH1A1NPSR1CTDSP1HTR7
SCHEMBL6943821 0.93 CA2 (0.56) CA2ALDH1A1NPSR1CTDSP1HTR7
SCHEMBL7042446 0.87 CA2 (0.53) CA2ALDH1A1NPSR1CTDSP1HTR7
SCHEMBL6941294 0.86 CA2 (0.49) CA2ALDH1A1NPSR1CTDSP1HTR7
SCHEMBL30697976 0.86 CA2 (0.49) CA2ALDH1A1NPSR1CTDSP1HTR7
SCHEMBL13063460 0.85 CA2 (0.51) CA2ALDH1A1NPSR1HTR7TMEM97
SCHEMBL10441415 0.85 CA2 (0.51) CA2ALDH1A1NPSR1CTDSP1HTR7
SCHEMBL30401615 0.83 CA2 (0.47) CA2ALDH1A1NPSR1HTR7TMEM97
SCHEMBL461346 0.83 CA2 (0.56) CA2ALDH1A1NPSR1CTDSP1HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090253733-A1 RAPAMYCIN CARBONATE ESTERS BIOINTERACTIONS, LTD. (GB) 2009-10-08 US claimed
US-5575944-A Acetal-containing working fluid composition for refrigerating machine KAO CORPORATION (JP) 1996-11-19 US claimed
WO-2016012345-A1 CYCLIC ACETAL DERIVATIVES AS ANTI-SOOT ADDITIVES FOR AN AVIATION FUEL RHODIA OPERATIONS (FR) 2016-01-28 WO disclosed
EP-2977433-A1 Cyclic acetal derivatives as anti-soot additives for aviation fuel Rhodia Opérations (FR) 2016-01-27 EP disclosed
US-20090253733-A1 RAPAMYCIN CARBONATE ESTERS BIOINTERACTIONS, LTD. (GB) 2009-10-08 US disclosed
WO-2009122176-A2 RAPAMYCIN CARBONATE ESTERS BIOINTERACTIONS LTD (GB) 2009-10-08 WO disclosed
US-5575944-A Acetal-containing working fluid composition for refrigerating machine KAO CORPORATION (JP) 1996-11-19 US 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 (1 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-20090253733-A1 RAPAMYCIN CARBONATE ESTERS CEL, MTOR, RICTOR CA2 177/4885ALDH1A1 3975/4885NPSR1 3970/4885

“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.