SCHEMBL18875293

SCHEMBL18875293

O=COc1cc(Br)cc(OC=O)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 2/20 0.32
SOD1 P00441 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL3194381 0.95 SOD1 (0.34) ERN1SOD1ALDH1A1
SCHEMBL21726722 0.89 ALDH1A1 (0.46) ERN1ALDH1A1
SCHEMBL18573171 0.86 ALDH1A1 (0.32) ALDH1A1
SCHEMBL12246759 0.80 POLB (0.40) ALDH1A1
SCHEMBL1825807 0.77 ALDH1A1 (0.48) SOD1ALDH1A1
SCHEMBL27955269 0.75 MAPT (0.46) ALDH1A1
SCHEMBL15115431 0.75 POLB (0.39)
SCHEMBL18875305 0.74 POLB (0.36)
SCHEMBL97752 0.74 CA1 (0.43) ALDH1A1
SCHEMBL16079851 0.74 ALDH1A1 (0.41) ERN1ALDH1A1

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
US-20170148996-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC OPTOELECTRONIC DEVICES COMPRISING THE SAME WUHAN TIANMA MICROELECTRONICS CO., LTD.SHANGHAI BRANCH (CN) 2017-05-25 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-20170148996-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC OPTOELECTRONIC DEVICES COMPRISING THE SAME OR10J3, PPOX, OR51E2 ERN1 2657/4885SOD1 160/4885ALDH1A1 625/4885

“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.