SCHEMBL6036890

SCHEMBL6036890

O=C(O)Oc1cccc2c1-c1ccccc1C2=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KEAP1 Q14145 4/20 0.50
TTR P02766 2/20 0.50
NFE2L2 Q16236 1/20 0.50
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
MAPT P10636 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ABCC4 O15439 1/20 0.48
USP2 O75604 1/20 0.48
TP53 P04637 1/20 0.48
HSP90AA1 P07900 1/20 0.48
CHRM2 P08172 1/20 0.48
HSP90AB1 P08238 1/20 0.48
HTR1A P08908 1/20 0.48
ADRA2A P08913 1/20 0.48
ADORA3 P0DMS8 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
SCHEMBL23212346 0.93 TTR (0.57) ALDH1A1L3MBTL1KEAP1TTRNFE2L2
SCHEMBL27961252 0.87 TOP1 (0.46) ALDH1A1TTRMEN1KMT2AMAPT
SCHEMBL1727899 0.87 TTR (0.54) ALDH1A1L3MBTL1TTRMEN1KMT2A
SCHEMBL7479718 0.86 ALDH1A1 (0.56) ALDH1A1L3MBTL1TTRMEN1KMT2A
SCHEMBL10526611 0.84 TTR (0.53) ALDH1A1L3MBTL1TTRMEN1KMT2A
SCHEMBL6220950 0.84 KEAP1 (0.49) ALDH1A1L3MBTL1KEAP1TTRNFE2L2
SCHEMBL7109053 0.83 ALDH1A1 (0.51) ALDH1A1L3MBTL1TTRMEN1KMT2A
SCHEMBL5306728 0.83 MAPT (0.57) ALDH1A1L3MBTL1TTRMEN1KMT2A
SCHEMBL2460415 0.83 ELANE (0.54) ALDH1A1L3MBTL1KEAP1TTRNFE2L2
SCHEMBL28707279 0.80 TYMS (0.47) ALDH1A1L3MBTL1KEAP1TTRNFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1185869-B1 LIGAND-ANCHOR CONJUGATES FOR PRODUCING A BIOSENSOR LAYER GRAFFINITY PHARMACEUTICALS AG (DE) 2006-07-26 EP disclosed
EP-1301464-A1 BIPHENYLCARBOXYLIC ACID AMIDES, PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS Boehringer Ingelheim Pharma KG (DE) 2003-04-16 EP disclosed
EP-1185869-A2 LIGAND-ANCHOR CONJUGATES FOR PRODUCING A BIOSENSOR LAYER Graffinity Pharmaceutical Design GmbH (DE) 2002-03-13 EP disclosed
WO-2002004403-A1 BIPHENYLCARBOXYLIC ACID AMIDES, PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-01-17 WO disclosed
WO-2000073796-A2 LIGAND-ANCHOR CONJUGATES FOR PRODUCING A BIOSENSOR LAYER GRAFFINITY PHARMACEUTICAL DESIGN GMBH (DE) 2000-12-07 WO disclosed
EP-0646593-A1 Corticoid-17,21-dicarboxylic acid ester and corticosteroid-17-carboxylic acid ester-21-carbonic, process for their production and medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1995-04-05 EP disclosed
EP-0640616-A2 17-Alkylcarbonate, 21-0-carbonic/carboxylic acid esters of corticosteroids, a method for their production and pharmaceutical compositions containing them HOECHST AKTIENGESELLSCHAFT (DE) 1995-03-01 EP disclosed