SCHEMBL4824490

SCHEMBL4824490

CCCCCCCCc1ccc(C(=O)NN)cc1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 4/20 0.65
SPHK2 Q9NRA0 2/20 0.62
SPHK1 Q9NYA1 2/20 0.62
THRA P10827 6/20 0.61
THRB P10828 6/20 0.61
RARB P10826 5/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
ALDH1A1 P00352 1/20 0.61
RARA P10276 1/20 0.61
MAPT P10636 1/20 0.61
MTOR P42345 1/20 0.61
HAO1 Q9UJM8 1/20 0.60
PLK3 Q9H4B4 3/20 0.58

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
SCHEMBL15174597 1.00 PLK1 (0.65) PLK1SPHK2SPHK1THRATHRB
SCHEMBL9164847 1.00 PLK1 (0.65) PLK1SPHK2SPHK1THRATHRB
SCHEMBL28709309 1.00 PLK1 (0.65) PLK1SPHK2SPHK1THRATHRB
SCHEMBL9206725 1.00 PLK1 (0.65) PLK1SPHK2SPHK1THRATHRB
SCHEMBL2747801 0.98 PLK1 (0.67) PLK1SPHK2SPHK1THRATHRB
SCHEMBL4189932 0.95 RARB (0.69) PLK1SPHK2SPHK1THRATHRB
SCHEMBL19443009 0.93 PLK1 (0.74) PLK1SPHK2SPHK1THRATHRB
SCHEMBL2831713 0.91 TRPV1 (0.68) PLK1SPHK1THRATHRBPLK3
Benzoic Acid Hydrazide SCHEMBL9007156 0.89 HDAC1 (0.58) PLK1THRATHRBRARBMEN1
SCHEMBL9504756 0.86 HDAC1 (0.73) PLK1THRATHRBRARBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7442760-B2 Electroactive polymers 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-10-28 US disclosed
US-20080026135-A1 ELECTRON TRANSPORT AGENTS FOR ORGANIC ELECTRONIC DEVICES 3M INNOVATIVE PROPERTIES COMPANY 2008-01-31 US disclosed
US-7271406-B2 Electron transport agents for organic electronic devices 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-09-18 US disclosed
US-7094902-B2 Electroactive polymers 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-08-22 US disclosed
US-20060155106-A1 ELECTROACTIVE POLYMERS 3M INNOVATIVE PROPERTIES COMPANY 2006-07-13 US disclosed
EP-1618169-A1 ELECTRON TRANSPORT AGENTS FOR ORGANIC ELECTRONIC DEVICES 3M Innovative Properties Company (US) 2006-01-25 EP disclosed
EP-1573789-A2 ELECTROACTIVE POLYMERS 3M Innovative Properties Company (US) 2005-09-14 EP disclosed
EP-1554360-A2 ORGANIC ELECTROLUMINESCENT COMPOSITIONS 3M Innovative Properties Company (US) 2005-07-20 EP disclosed
WO-2004102615-A2 ELECTROACTIVE POLYMERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-11-25 WO disclosed
WO-2004099338-A2 ORGANIC ELECTROLUMINESCENT COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-11-18 WO disclosed
WO-2004096948-A1 ELECTRON TRANSPORT AGENTS FOR ORGANIC ELECTRONIC DEVICES 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-11-11 WO disclosed
US-20040214036-A1 Electron transport agents for organic electronic devices 3M INNOVATIVE PROPERTIES COMPANY 2004-10-28 US disclosed
US-20040062930-A1 Electroactive polymers 3M INNOVATIVE PROPERTIES COMPANY 2004-04-01 US disclosed
US-20040062947-A1 Organic electroluminescent compositions 3M INNOVATIVE PROPERTIES COMPANY 2004-04-01 US disclosed
EP-0632116-B1 A smectic C liquid crystal composition and a liquid crystal display element CHISSO CORP (JP) 1999-09-08 EP disclosed
US-5658492-A POSITIONING LIQUID CRYSTAL BETWEEN THE PAIR OF INSULATING SUBSTRATE, EACH HAVING AN ELECTRODE, SELECTIVELY IMPRESSING A VOLTAGE ONTO SAID ELECTRODE CHISSO CORPORATION (JP) 1997-08-19 US disclosed
US-5529717-A CONTAINING DIPHENYLTHIADIAZOLE AND ALKOXYPHENYLPYRIDINE COMPOUNDS CHISSO CORPORATION (JP) 1996-06-25 US disclosed
EP-0632116-A1 A smectic C liquid crystal composition and a liquid crystal display element CHISSO CORPORATION (JP) 1995-01-04 EP disclosed
US-4952699-A Liquid-crystalline, 2,5-disubstituted, 1,3,4-thiadiazoles with extended smectic C phases VEB WERK FUER FERNSEHELEKTRONIK IM VEB KOMBINAT MIKROELEKTRONIK (DD) 1990-08-28 US disclosed