SCHEMBL4584090

SCHEMBL4584090

OCCOB(O)c1ccc(B(O)O)c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.35
IDO1 P14902 1/20 0.35
ALDH1A1 P00352 2/20 0.34
RECQL P46063 1/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ENPP2 Q13822 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL4585049 0.95 LIPE (0.33) LIPEIDO1ALDH1A1RECQLMAPT
SCHEMBL5953133 0.81 HTR1B (0.40) IDO1ALDH1A1RECQLMAPTMEN1
SCHEMBL4271540 0.77 IDO1 (0.39) IDO1ALDH1A1RECQLMEN1KMT2A
SCHEMBL1760270 0.76 ALDH1A1 (0.38) LIPEALDH1A1RECQLMAPTKMT2A
SCHEMBL4275372 0.76 IDO1 (0.36) IDO1ALDH1A1RECQLMEN1KMT2A
SCHEMBL1427222 0.76 MAPT (0.50) LIPEIDO1ALDH1A1MAPTENPP2
SCHEMBL29875461 0.76 MAPT (0.50) LIPEIDO1ALDH1A1MAPTENPP2
SCHEMBL29957101 0.75 MAPT (0.39) LIPEMAPTENPP2KDM4E
SCHEMBL5166207 0.73 ALDH1A1 (0.35) ALDH1A1RECQLENPP2
SCHEMBL5952005 0.71 KDM4E (0.44) ALDH1A1MAPTMEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957606-B1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINIESCENT DEVICES MERCK PATENT GMBH (DE) 2017-11-08 EP disclosed
US-9017825-B2 Anthracene derivatives and their use in organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-04-28 US disclosed
US-20080303423-A1 Novel Materials For Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-12-11 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-20080303423-A1 Novel Materials For Organic Electroluminescent Devices ANXA2, ANXA7, ANXA1 LIPE 4276/4885IDO1 3544/4885ALDH1A1 576/4885

“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.