SCHEMBL12865356

SCHEMBL12865356

O=C1OBOc2ccc3ccccc3c21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.46
DNMT1 P26358 1/20 0.46
KDM4E B2RXH2 5/20 0.46
ALDH1A1 P00352 5/20 0.46
HSD17B10 Q99714 3/20 0.46
HPGD P15428 3/20 0.46
TSHR P16473 2/20 0.46
ALOX15 P16050 1/20 0.46
HTT P42858 1/20 0.46
NPC1 O15118 2/20 0.42
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.42
CYP19A1 P11511 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GLA P06280 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SIRT1 Q96EB6 1/20 0.41

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
SCHEMBL5899656 0.88 GPR84 (0.52) GPR84DNMT1KDM4EALDH1A1HSD17B10
SCHEMBL9116047 0.75 HSD17B10 (0.44) GPR84KDM4EALDH1A1HSD17B10HPGD
SCHEMBL12865358 0.70 DNMT1 (0.46) DNMT1KDM4EALDH1A1HSD17B10HPGD
SCHEMBL289872 0.69 KDM4E (0.64) GPR84DNMT1KDM4EALDH1A1HSD17B10
SCHEMBL86321 0.67 CYP19A1 (0.53) GPR84DNMT1KDM4EALDH1A1HSD17B10
SCHEMBL12216282 0.65 HTR2A (0.38) KDM4EALDH1A1HSD17B10HPGDTSHR
SCHEMBL1777121 0.65 GPR84 (0.53) GPR84DNMT1KDM4EALDH1A1HSD17B10
SCHEMBL22664856 0.65 GPR84 (0.53) GPR84DNMT1KDM4EALDH1A1HSD17B10
SCHEMBL30428179 0.65 GPR84 (0.53) GPR84DNMT1KDM4EALDH1A1HSD17B10
SCHEMBL30901145 0.65 GPR84 (0.53) GPR84DNMT1KDM4EALDH1A1HSD17B10

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 GPR84 1215/4885DNMT1 2033/4885KDM4E 4724/4885

“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.