SCHEMBL6859299

SCHEMBL6859299

CCOC(=O)c1cc(-c2ccc(CC(C)C)c(CC(C)C)c2)c(C(=O)OCC)cc1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
GAA P10253 2/20 0.41
KMT2A Q03164 2/20 0.40
MAPT P10636 4/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
ERN1 O75460 1/20 0.39
PRKCZ Q05513 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
HSD17B2 P37059 1/20 0.38
POLB P06746 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.38
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
ATM Q13315 1/20 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
SCHEMBL6852154 0.85 SMN1; SMN2 (0.38) ALDH1A1KMT2AMAPTTHRBPRKCZ
SCHEMBL7980488 0.76 HTT (0.60) ALDH1A1GAAKMT2AMAPTHTT
SCHEMBL2900687 0.75 KMT2A (0.65) ALDH1A1GAAKMT2AMAPTL3MBTL1
SCHEMBL6858913 0.74 KMT2A (0.47) ALDH1A1GAAKMT2AMAPTHTT
SCHEMBL6858932 0.73 GAA (0.42) ALDH1A1GAAKMT2AMAPTL3MBTL1
SCHEMBL3904758 0.72 HSD17B2 (0.62) ALDH1A1GAAKMT2AMAPTHSD17B2
SCHEMBL29196254 0.72 SMN1; SMN2 (0.47) GAAKMT2AMAPTHTTHSD17B2
SCHEMBL5885634 0.72 DHODH (0.46) ALDH1A1GAAKMT2AMAPTHTT
SCHEMBL29900125 0.72 ERN1 (0.52) ALDH1A1GAAKMT2AMAPTHTT
SCHEMBL7980571 0.71 HTT (0.54) ALDH1A1GAAKMT2AMAPTHTT

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
EP-1029019-B1 SUBSTITUTED POLY(ARYLENE VINYLENES), METHOD FOR PRODUCING THE SAME, AND THEIR USE IN ELECTROLUMINESCENT ELEMENTS COVION ORGANIC SEMICONDUCTORS (DE) 2004-03-03 EP disclosed
US-6638646-B2 Polymerizing one or more monomers containing dihalogen containing substituted biaryls, via a base-induced dehydrohalogenation SEMICONDUCTORS GMBH (DE) 2003-10-28 US disclosed
US-20030088050-A1 Substituted poly(arylenevinylenes), process for their preparation, and their use in electroluminescent elements MERCK PATENT GMBH (DE) 2003-05-08 US disclosed
US-20020064680-A1 Substituted poly(arylene vinylenes), method for producing the same, and their use in electroluminescent elements AXIVA GMBH (DE) 2002-05-30 US disclosed
EP-1029019-A1 SUBSTITUTED POLY(ARYLENE VINYLENES), METHOD FOR PRODUCING THE SAME, AND THEIR USE IN ELECTROLUMINESCENT ELEMENTS Axiva GmbH (DE) 2000-08-23 EP disclosed
WO-1999024526-A1 SUBSTITUTED POLY(ARYLENE VINYLENES), METHOD FOR PRODUCING THE SAME, AND THEIR USE IN ELECTROLUMINESCENT ELEMENTS AXIVA GMBH (DE) 1999-05-20 WO disclosed