SCHEMBL12200434

SCHEMBL12200434

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c5cccc6cccc(c7cccc3c74)c65)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
HPGD P15428 5/20 0.41
MAPT P10636 4/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
HSD17B10 Q99714 3/20 0.41
TSHR P16473 3/20 0.41
MAPK1 P28482 3/20 0.41
ATM Q13315 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 2/20 0.41
TP53 P04637 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP1A2 P05177 2/20 0.41
THRB P10828 1/20 0.41
ADORA3 P0DMS8 2/20 0.39
ADORA2A P29274 2/20 0.39
ADORA2B P29275 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
SCHEMBL12200428 0.88 CYP1A2 (0.43) ALDH1A1HPGDMAPTL3MBTL1HSD17B10
SCHEMBL24472998 0.87 ALDH1A1 (0.44) ALDH1A1HPGDMAPTL3MBTL1HSD17B10
SCHEMBL24473015 0.87 ALDH1A1 (0.47) ALDH1A1HPGDMAPTL3MBTL1HSD17B10
SCHEMBL20624290 0.87 CYP1A2 (0.45) ALDH1A1HPGDMAPTL3MBTL1HSD17B10
SCHEMBL17995337 0.86 CYP1A2 (0.42) ALDH1A1HPGDMAPTL3MBTL1HSD17B10
SCHEMBL12200479 0.85 L3MBTL1 (0.47) ALDH1A1HPGDMAPTL3MBTL1HSD17B10
SCHEMBL25668571 0.85 ALDH1A1 (0.49) ALDH1A1HPGDMAPTL3MBTL1HSD17B10
SCHEMBL23759455 0.85 ALDH1A1 (0.45) ALDH1A1HPGDMAPTL3MBTL1HSD17B10
SCHEMBL12200448 0.85 CYP1A1 (0.41) ALDH1A1HPGDMAPTL3MBTL1HSD17B10
SCHEMBL16521876 0.85 CYP1A2 (0.46) ALDH1A1HPGDMAPTL3MBTL1HSD17B10

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-8765270-B2 Triazine compound and organic light emitting device using the same CANON KABUSHIKI KAISHA (JP) 2014-07-01 US disclosed
US-8765270-B2 Triazine compound and organic light emitting device using the same CANON KABUSHIKI KAISHA (JP) 2014-07-01 US disclosed
US-20110240983-A1 TRIAZINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-10-06 US disclosed
US-20110240983-A1 TRIAZINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-10-06 US disclosed
WO-2010067894-A1 TRIAZINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2010-06-17 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-20110240983-A1 TRIAZINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME TERT, CYP1A1, NR2E3 ALDH1A1 44/4885HPGD 2320/4885MAPT 888/4885

“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.