SCHEMBL12865358

SCHEMBL12865358

O=C1OBOc2c1ccc1ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 1/20 0.46
PAX8 Q06710 1/20 0.44
CYP19A1 P11511 3/20 0.43
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 3/20 0.42
HPGD P15428 3/20 0.42
MAPT P10636 2/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MEN1 O00255 2/20 0.42
TP53 P04637 2/20 0.42
MAPK1 P28482 2/20 0.42
KMT2A Q03164 2/20 0.42
HTT P42858 2/20 0.42
HCRTR1 O43613 1/20 0.42
CYP2A6 P11509 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HTR2C P28335 3/20 0.39
HTR2A P28223 2/20 0.39
CYP1A2 P05177 2/20 0.39

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
SCHEMBL9116047 0.75 HSD17B10 (0.44) ALDH1A1KDM4EHPGDMAPTTSHR
SCHEMBL31217582 0.71 ALDH1A1 (0.47) DNMT1PAX8CYP19A1ALDH1A1KDM4E
SCHEMBL4946125 0.71 PAX8 (0.41) DNMT1PAX8CYP19A1ALDH1A1KDM4E
SCHEMBL12865356 0.70 GPR84 (0.46) DNMT1PAX8CYP19A1ALDH1A1KDM4E
SCHEMBL14570655 0.68 ALDH1A1 (0.43) DNMT1PAX8CYP19A1ALDH1A1KDM4E
SCHEMBL86747 0.67 CYP19A1 (0.54) DNMT1PAX8CYP19A1ALDH1A1KDM4E
SCHEMBL12216282 0.65 HTR2A (0.38) ALDH1A1KDM4EHPGDMAPTTSHR
SCHEMBL19230419 0.65 DNMT1 (0.83) DNMT1PAX8ALDH1A1KDM4EHPGD
SCHEMBL13397738 0.64 ALDH1A1 (0.54) DNMT1PAX8CYP19A1ALDH1A1KDM4E
SCHEMBL5899656 0.64 GPR84 (0.52) DNMT1CYP19A1ALDH1A1KDM4EHPGD

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
US-7884209-B2 as redox-dopant and/or emitter in electronic, optoelectronic or electroluminescent structural elements; oxidation and moisture resistance NOVALED AG (DE) 2011-02-08 US disclosed
US-7884209-B2 as redox-dopant and/or emitter in electronic, optoelectronic or electroluminescent structural elements; oxidation and moisture resistance NOVALED AG (DE) 2011-02-08 US disclosed
US-20100234608-A1 Use of Bora-Tetraazapentalenes NOVALED AG (DE) 2010-09-16 US disclosed
US-20100234608-A1 Use of Bora-Tetraazapentalenes NOVALED AG (DE) 2010-09-16 US disclosed
WO-2007115540-A1 USE OF BORA-TETRAAZAPENTALENES NOVALED AG (DE) 2007-10-18 WO 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-20100234608-A1 Use of Bora-Tetraazapentalenes ETFA, GPX1, CYBB DNMT1 2033/4885PAX8 243/4885CYP19A1 101/4885

“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.