SCHEMBL1406299

SCHEMBL1406299

CC(=O)C(C)(CCC(=O)OCCO)C(C)=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.38
ADRA2A P08913 1/20 0.36
ADRA1A P35348 1/20 0.36
MAPT P10636 1/20 0.35
BLM P54132 1/20 0.35
DGKA P23743 1/20 0.34
GAA P10253 1/20 0.32
TSHR P16473 1/20 0.32
ACHE P22303 1/20 0.31
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30

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
SCHEMBL13387963 0.84 MGLL (0.40) MGLLADRA2AADRA1AMAPTBLM
SCHEMBL9821323 0.82 MGLL (0.41) MGLLADRA2AADRA1AMAPTBLM
SCHEMBL1406673 0.81 DGKA (0.48) MAPTDGKATSHR
SCHEMBL1406319 0.80 CYP1A2 (0.45) GAATSHRCYP4F2CYP4A11
SCHEMBL1406708 0.79 NAAA (0.55) DGKATSHR
SCHEMBL1406434 0.79 NAAA (0.55) DGKATSHR
SCHEMBL3281616 0.77 DGKA (0.43) MGLLADRA2AADRA1AMAPTBLM
SCHEMBL9821471 0.74 MGLL (0.46) MGLLADRA2AADRA1AMAPTBLM
SCHEMBL14193599 0.74 MGLL (0.36) MGLLADRA2AADRA1AMAPTBLM
SCHEMBL475320 0.73 ADRA2A (0.52) MGLLADRA2AADRA1AMAPTBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1490412-B1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK & CHEMICALS (JP) 2011-03-09 EP disclosed
US-7705064-B2 Photosensitive compounds, photopolymerizable compositions including the same, and methods of making and using the same HENKEL CORPORATION (US) 2010-04-27 US disclosed
US-7705064-B2 Photosensitive compounds, photopolymerizable compositions including the same, and methods of making and using the same HENKEL CORPORATION (US) 2010-04-27 US disclosed
US-20090030106-A1 Photosensitive Compounds, Photopolymerizable Compositions Including the Same, and Methods of Making and Using the Same HENKEL CORPORATION (US) 2009-01-29 US disclosed
US-20090030106-A1 Photosensitive Compounds, Photopolymerizable Compositions Including the Same, and Methods of Making and Using the Same HENKEL CORPORATION (US) 2009-01-29 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-20090030106-A1 Photosensitive Compounds, Photopolymerizable Compositions Including the Same, and Methods of Making and Using the Same PHYKPL, AHCY, ALAD MGLL 1295/4885ADRA2A 3687/4885ADRA1A 3888/4885

“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.