SCHEMBL2876291

SCHEMBL2876291

COc1cccc(-c2ccccc2-c2nc(-c3ccccc3-c3cccc(OC)c3)nc(-c3ccccc3-c3cccc(OC)c3)n2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 2/20 0.56
DYRK1A Q13627 1/20 0.56
RAB9A P51151 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
NPC1 O15118 2/20 0.54
NFKB1 P19838 2/20 0.54
NFKB2 Q00653 2/20 0.54
RELA Q04206 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
TP53 P04637 1/20 0.54
NR1H2 P55055 1/20 0.53
NR1H3 Q13133 1/20 0.53
ADORA2A P29274 2/20 0.52
ADORA1 P30542 2/20 0.52
CYP1A2 P05177 4/20 0.51
CYP3A4 P08684 4/20 0.51
CYP2C9 P11712 4/20 0.51
CYP2B6 P20813 3/20 0.51
AHR P35869 2/20 0.51
NR1I3 Q14994 2/20 0.51

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
SCHEMBL2020140 0.89 ABL1 (0.59) CLK4DYRK1ARAB9ASMN1; SMN2NPC1
SCHEMBL3455245 0.85 ABL1 (0.60) CLK4DYRK1ARAB9ASMN1; SMN2NPC1
SCHEMBL13211663 0.85 ABL1 (0.60) CLK4DYRK1AADORA2AADORA1CYP1A2
SCHEMBL28315176 0.81 CYP1A2 (0.67) CLK4DYRK1ARAB9ASMN1; SMN2NPC1
SCHEMBL29712524 0.81 CYP1A2 (0.67) CLK4DYRK1ARAB9ASMN1; SMN2NPC1
SCHEMBL10023268 0.80 ACHE (0.64) CLK4DYRK1ARAB9ASMN1; SMN2NPC1
SCHEMBL12811023 0.80 ADORA2A (0.57) CLK4DYRK1ARAB9ASMN1; SMN2NPC1
SCHEMBL2876558 0.79 ABL1 (0.63) CLK4RAB9ASMN1; SMN2NPC1NFKB1
SCHEMBL5286981 0.79 BRD4 (0.55) CLK4DYRK1AADORA2AADORA1CYP1A2
SCHEMBL5849737 0.78 CYP1A1 (0.65) CLK4DYRK1ASMN1; SMN2TDP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7777407-B2 Organic light emitting devices comprising a doped triazine electron transport layer LG DISPLAY CO., LTD. (KR) 2010-08-17 US disclosed
US-20090102373-A1 Electroluminescent device HAYOZ PASCAL 2009-04-23 US disclosed
US-20080199726-A1 Electroluminescent Device CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2008-08-21 US disclosed
EP-1743011-A1 ELECTROLUMINESCENT DEVICE CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2007-01-17 EP disclosed
US-20060251920-A1 Organic light emitting devices comprising a doped triazine electron transport layer XEROX CORPORATION 2006-11-09 US disclosed
US-20060251919-A1 Organic light emitting devices XEROX CORPORATION 2006-11-09 US disclosed
EP-1597938-A2 ELECTROLUMINESCENT DEVICE Ciba SC Holding AG (CH) 2005-11-23 EP disclosed
WO-2005105950-A1 ELECTROLUMINESCENT DEVICE CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2005-11-10 WO disclosed
US-6821643-B1 SATISFACTORY EMISSION IN THE VISIBLE SPECTRUM FROM BLUE TO LONGER WAVELENGTH REGIONS XEROX CORPORATION 2004-11-23 US disclosed
WO-2004077885-A2 ELECTROLUMINESCENT DEVICE CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-09-10 WO disclosed
US-6225467-B1 UNIFORM LUMINESCENCE, ELECTROLUMINESCENT EFFICIENCY, DURABILITY, LOW DRIVING VOLTAGE; FOR USE IN FLAT-PANEL EMISSIVE DISPLAY TECHNOLOGIES, INCLUDING TELEVISION SCREENS, COMPUTER SCREENS XEROX CORPORATION 2001-05-01 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 (2 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-20090102373-A1 Electroluminescent device TAAR5, TYR, TRPC5 CLK4 1278/4885DYRK1A 2859/4885RAB9A 3537/4885
US-20080199726-A1 Electroluminescent Device TPMT, THPO, KYNU CLK4 3815/4885DYRK1A 3789/4885RAB9A 4428/4885

“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.