SCHEMBL1494495

SCHEMBL1494495

CCCc1cccnc1[O]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.45
ADRA2B P18089 3/20 0.38
ADRA2C P18825 3/20 0.38
ADRA2A P08913 2/20 0.38
HTR1A P08908 1/20 0.36
NISCH Q9Y2I1 1/20 0.36
ELANE P08246 1/20 0.36
KDM4E B2RXH2 4/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 2/20 0.35
GAA P10253 1/20 0.35
CYP1A2 P05177 1/20 0.35
MAPT P10636 1/20 0.35
POLB P06746 1/20 0.35
PDE10A Q9Y233 1/20 0.34
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33

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
SCHEMBL1494296 0.88 CYP3A4 (0.39) GRM5ALDH1A1HPGDPDE4APDE4B
SCHEMBL1494190 0.86 TDP1 (0.44)
SCHEMBL1494163 0.85 LIPG (0.47)
SCHEMBL1494525 0.85 LIPG (0.47)
SCHEMBL1494508 0.85 LIPG (0.47)
SCHEMBL1494506 0.85 LIPG (0.47)
SCHEMBL1494257 0.85 LIPG (0.47)
SCHEMBL1494162 0.85 LIPG (0.47)
SCHEMBL1494492 0.85
SCHEMBL1494230 0.79 ALOX5AP (0.36) KDM4EALDH1A1CYP1A2MAPTSLC13A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9735374-B2 Metal complex and light-emitting device containing the metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-15 US disclosed
US-9705097-B2 Metal complex and light-emitting device containing the metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-07-11 US disclosed
US-9048442-B2 Composition containing a metal complex and organic compound, and light-emitting element using said compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-06-02 US disclosed
EP-2305772-B1 COMPOSITION CONTAINING A METAL COMPLEX AND ORGANIC COMPOUND, AND LIGHT EMITTING ELEMENT USING SAID COMPOUND SUMITOMO CHEMICAL CO (JP) 2015-05-20 EP disclosed
US-20140374727-A1 METAL COMPLEX AND LIGHT-EMITTING DEVICE CONTAINING THE METAL COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-12-25 US disclosed
US-20140306203-A1 METAL COMPLEX AND LIGHT-EMITTING DEVICE COMPRISING THE METAL COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-10-16 US disclosed
EP-2492276-B1 METAL COMPLEX, POLYMER, AND ELEMENT OBTAINED USING SAME SUMITOMO CHEMICAL CO (JP) 2014-10-08 EP disclosed
US-20140183414-A1 POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-07-03 US disclosed
US-8608986-B2 Metal complex, polymer compound and device containing those SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-12-17 US disclosed
US-8592544-B2 Polymeric compound containing metal complex residue and element comprising same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-11-26 US disclosed
EP-2309563-A1 COMPOSITION AND LIGHT-EMITTING ELEMENT USING THE COMPOSITION Sumitomo Chemical Company, Limited (JP) 2011-04-13 EP disclosed
EP-2305772-A1 COMPOSITION CONTAINING A METAL COMPLEX AND ORGANIC COMPOUND, AND LIGHT EMITTING ELEMENT USING SAID COMPOUND Sumitomo Chemical Company, Limited (JP) 2011-04-06 EP disclosed
EP-2298828-A1 POLYMERIC COMPOUND CONTAINING METAL COMPLEX RESIDUE AND ELEMENT COMPRISING SAME Sumitomo Chemical Company, Limited (JP) 2011-03-23 EP disclosed
US-20100264812-A1 METAL COMPLEX, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-10-21 US disclosed
US-20100177264-A1 LIGHT-EMITTING MATERIAL CONTAINING METAL COMPLEX AND PHOTOELECTRIC DEVICE USING SAME SUMITOMO CHECMICAL COMPANY, LIMITED (JP) 2010-07-15 US disclosed
US-20100019669-A1 METAL COMPLEX, POLYMER COMPOUND AND DEVICE CONTAINING THOSE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-01-28 US disclosed
EP-2128168-A1 METAL COMPLEX, POLYMER COMPOUND AND DEVICE CONTAINING THOSE Sumitomo Chemical Company, Limited (JP) 2009-12-02 EP disclosed
US-20090043064-A1 METAL COMPLEX, POLYMER COMPOUND, AND DEVICE CONTAINING IT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-02-12 US disclosed
EP-1932851-A1 METAL COMPLEX, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING DEVICE Sumitomo Chemical Company, Limited (JP) 2008-06-18 EP disclosed
EP-1930392-A1 LIGHT-EMITTING MATERIAL CONTAINING METAL COMPLEX AND PHOTOELECTRIC DEVICE USING SAME Sumitomo Chemical Company, Limited (JP) 2008-06-11 EP 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 (3 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-20090043064-A1 METAL COMPLEX, POLYMER COMPOUND, AND DEVICE CONTAINING IT TIMCC, AP1M1, TXN GRM5 1783/4885ADRA2B 3821/4885ADRA2C 3178/4885
US-20100019669-A1 METAL COMPLEX, POLYMER COMPOUND AND DEVICE CONTAINING THOSE AP1M1, MRPL21, C1R GRM5 527/4885ADRA2B 4051/4885ADRA2C 3979/4885
US-20100264812-A1 METAL COMPLEX, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING DEVICE SOD1, CRY1, YAP1 GRM5 1544/4885ADRA2B 2445/4885ADRA2C 1958/4885

“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.