SCHEMBL2385805

SCHEMBL2385805

O=Cc1ccccc1-c1ccc(OC(O)CCO)cc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.40
PPARA Q07869 15/20 0.39
PPARG P37231 13/20 0.39
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35
DRD1 P21728 1/20 0.35
ERN1 O75460 1/20 0.33

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
SCHEMBL4148464 0.77 PPARG (0.45) PPARAPPARG
SCHEMBL2384646 0.77 TSHR (0.42) XDH
SCHEMBL27205115 0.75 ALDH1A1 (0.46) XDHERN1
SCHEMBL2569853 0.74 ALDH1A1 (0.45) PPARAPPARG
SCHEMBL30497064 0.74 LMNA (0.60) XDHDRD2DRD4DRD1ERN1
SCHEMBL11768743 0.74 LMNA (0.60) XDHDRD2DRD4DRD1ERN1
SCHEMBL6255413 0.73 SLC6A4 (0.41) XDH
SCHEMBL18244276 0.72 HDAC3 (0.44)
SCHEMBL3677399 0.72 ALDH1A1 (0.59) XDHERN1
SCHEMBL28009606 0.71 ERN1 (0.49) XDHERN1

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-2199273-B1 Polymerizable photoinitiators and radiation curable compositions AGFA NV (BE) 2018-02-21 EP disclosed
US-8492452-B2 Polymerizable photoinitiators and radiation curable compositions AGFA GRAPHICS NV (BE) 2013-07-23 US disclosed
US-20110224324-A1 POLYMERIZABLE PHOTOINITIATORS AND RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2011-09-15 US disclosed
WO-2010069758-A1 POLYMERIZABLE PHOTOINITIATORS AND RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2010-06-24 WO disclosed
EP-2199273-A1 Polymerizable photoinitiators and radiation curable compositions AGFA Graphics NV (BE) 2010-06-23 EP 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-20110224324-A1 POLYMERIZABLE PHOTOINITIATORS AND RADIATION CURABLE COMPOSITIONS WEE1, ZYX, MTR XDH 1452/4885PPARA 1522/4885PPARG 1352/4885

“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.