SCHEMBL347643

SCHEMBL347643

c1ccc(-n2c(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc3ccccc32)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.64
ESR2 Q92731 2/20 0.64
GRIA1 P42261 1/20 0.58
CACNG8 Q8WXS5 1/20 0.58
CACNG2 Q9Y698 1/20 0.58
KDM4E B2RXH2 2/20 0.55
ATM Q13315 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
HTT P42858 2/20 0.53
MAPK1 P28482 1/20 0.53
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
HSP90AA1 P07900 1/20 0.52
MAPT P10636 1/20 0.52
PTGS2 P35354 1/20 0.52
ALDH1A1 P00352 7/20 0.49
RECQL P46063 1/20 0.49
PRKACA P17612 1/20 0.48
RPS6KB1 P23443 1/20 0.48
GSK3B P49841 1/20 0.48

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
SCHEMBL12205094 1.00 ESR1 (0.64) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL10055038 1.00 ESR1 (0.64) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL10047619 1.00 ESR1 (0.64) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL13314068 0.98 ESR1 (0.66) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL23097286 0.94 ESR1 (0.58) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL22618148 0.94 ESR2 (0.72) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL19238820 0.93 ESR1 (0.56) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL12114860 0.93 ESR2 (0.56) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL15835152 0.93 ESR1 (0.59) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL12114718 0.93 ESR2 (0.56) ESR1ESR2GRIA1CACNG8CACNG2

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9853220-B2 Efficient organic light-emitting diodes and fabrication of the same NITTO DENKO CORPORATION (JP) 2017-12-26 US disclosed
US-9853220-B2 Efficient organic light-emitting diodes and fabrication of the same NITTO DENKO CORPORATION (JP) 2017-12-26 US disclosed
EP-2448925-B1 EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORP (JP) 2017-12-06 EP disclosed
EP-2448925-B1 EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORP (JP) 2017-12-06 EP disclosed
US-20150041780-A1 EFFICIENT ORGANIC LIGHT-EMITTING DIODES AND FABRICATION OF THE SAME NITTO DENKO CORPORATION (JP) 2015-02-12 US disclosed
US-20150041780-A1 EFFICIENT ORGANIC LIGHT-EMITTING DIODES AND FABRICATION OF THE SAME NITTO DENKO CORPORATION (JP) 2015-02-12 US disclosed
US-8927121-B2 Emissive aryl-heteroaryl compounds NITTO DENKO CORPORATION (JP) 2015-01-06 US disclosed
US-8927121-B2 Emissive aryl-heteroaryl compounds NITTO DENKO CORPORATION (JP) 2015-01-06 US disclosed
US-8927121-B2 Emissive aryl-heteroaryl compounds NITTO DENKO CORPORATION (JP) 2015-01-06 US disclosed
US-8771845-B2 2014-07-08 US disclosed
US-20120015998-A1 PHOTOTHERAPY METHODS AND DEVICES COMPRISING EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2012-01-19 US disclosed
US-20120015998-A1 PHOTOTHERAPY METHODS AND DEVICES COMPRISING EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2012-01-19 US disclosed
US-20120015998-A1 PHOTOTHERAPY METHODS AND DEVICES COMPRISING EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2012-01-19 US disclosed
WO-2012009283-A1 PHOTOTHERAPY METHODS AND DEVICES COMPRISING EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2012-01-19 WO disclosed
WO-2012009283-A1 PHOTOTHERAPY METHODS AND DEVICES COMPRISING EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2012-01-19 WO disclosed
WO-2011008560-A1 EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2011-01-20 WO disclosed
WO-2011008560-A1 EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2011-01-20 WO disclosed
US-20100326526-A1 EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2010-12-30 US disclosed
US-20100326526-A1 EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2010-12-30 US disclosed
US-20100326526-A1 EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2010-12-30 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-20120015998-A1 PHOTOTHERAPY METHODS AND DEVICES COMPRISING EMISSIVE ARYL-HETEROARYL COMPOUNDS ARNT, AHR, AR ESR1 51/4885ESR2 14/4885GRIA1 581/4885
US-20100326526-A1 EMISSIVE ARYL-HETEROARYL COMPOUNDS AHR, AR, ARNT ESR1 43/4885ESR2 11/4885GRIA1 314/4885

“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.