SCHEMBL5838772

SCHEMBL5838772

O=C(O)c1nccc(O)c1C(=O)O.[B]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.50
ASPH Q12797 5/20 0.50
KDM8 Q8N371 5/20 0.50
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
MAPT P10636 4/20 0.44
ALDH1A1 P00352 4/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
BLM P54132 1/20 0.44
AGER Q15109 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CYP1A2 P05177 1/20 0.39
KDM4A O75164 3/20 0.37

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
SCHEMBL1002512 0.98 KDM4E (0.52) KDM4EASPHKDM8CA12CA1
SCHEMBL28908994 0.96 KDM4E (0.50) KDM4EASPHKDM8CA12CA1
SCHEMBL8780489 0.96 KDM4E (0.50) KDM4EASPHKDM8CA12CA1
SCHEMBL27643444 0.96 KDM4E (0.50) KDM4EASPHKDM8CA12CA1
SCHEMBL3112069 0.96 KDM4E (0.50) KDM4EASPHKDM8CA12CA1
SCHEMBL29525861 0.78 KDM4E (0.53) KDM4EASPHKDM8CA12CA1
SCHEMBL7067358 0.78 CA12 (0.50) KDM4EASPHKDM8CA12CA1
SCHEMBL1332334 0.78 KDM4E (0.48) KDM4EASPHKDM8MAPTALDH1A1
SCHEMBL547943 0.77 KDM4E (0.68) KDM4EASPHKDM8MAPTALDH1A1
SCHEMBL9684174 0.75 KDM4E (0.50) KDM4EASPHKDM8MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7108802-B2 Electroluminescent material containing a conjugated polymer or metal complexes inside zeolites and porous materials and the preparation method thereof CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2006-09-19 US claimed
US-20050163992-A1 Electroluminescent material containing a conjugated polymer or earth metal complexes inside zeolites and porous materials and the preparation method thereof UNIVERSIDAD POLITECNICA DE VALENCIA (ES) 2005-07-28 US claimed
EP-1541526-A1 ELECTROLUMINESCENT MATERIAL CONTAINING A CONJUGATED POLYMER OR EARTH METAL COMPLEXES INSIDE ZEOLITES AND POROUS MATERIALS AND THE PREPARATION METHOD THEREOF CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2005-06-15 EP claimed
US-7108802-B2 Electroluminescent material containing a conjugated polymer or metal complexes inside zeolites and porous materials and the preparation method thereof CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2006-09-19 US disclosed
US-20050163992-A1 Electroluminescent material containing a conjugated polymer or earth metal complexes inside zeolites and porous materials and the preparation method thereof UNIVERSIDAD POLITECNICA DE VALENCIA (ES) 2005-07-28 US disclosed
EP-1541526-A1 ELECTROLUMINESCENT MATERIAL CONTAINING A CONJUGATED POLYMER OR EARTH METAL COMPLEXES INSIDE ZEOLITES AND POROUS MATERIALS AND THE PREPARATION METHOD THEREOF CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2005-06-15 EP disclosed