SCHEMBL5169946

SCHEMBL5169946

O=P(O)(Nc1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.52
CA4 P22748 2/20 0.52
CA5A P35218 2/20 0.52
CA12 O43570 2/20 0.47
CA9 Q16790 2/20 0.47
CFTR P13569 1/20 0.46
KDM4E B2RXH2 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
TSHR P16473 3/20 0.43
ALOX15 P16050 2/20 0.43
CA1 P00915 1/20 0.42
CA7 P43166 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
GGH Q92820 1/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
RECQL P46063 1/20 0.41
MMP8 P22894 1/20 0.41
MMP14 P50281 1/20 0.41

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
SCHEMBL16868468 0.88 CA14 (0.49) CA2CA4CA5ACA12CA9
SCHEMBL8081387 0.78 CA9 (0.52) CA2CA4CA5ACA12CA9
SCHEMBL3068557 0.78 CA2 (0.59) CA2CA4CA5ACA12CA9
SCHEMBL195068 0.78 CA9 (0.52) CA2CA4CA5ACA12CA9
SCHEMBL13043277 0.76 KDM4E (0.48) CA2CA4CA5ACA12CA9
SCHEMBL9328080 0.76 CA9 (0.50) CA2CA4CA5ACA12CA9
SCHEMBL16868500 0.76 KCNA5 (0.59) CA2CA4CA5ACA12CA9
SCHEMBL5169942 0.74 KDM4E (0.47) CA2CA4CA5ACA12CA9
SCHEMBL8632209 0.74 NPSR1 (0.50) CA2CA4CA5ACA12CA9
SCHEMBL6831560 0.74 CA9 (0.48) CA2CA4CA5ACA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109761944-A A kind of chrysin amide derivatives and preparation method thereof and medical usage 武汉翼博济生生物科技有限公司 2019-05-17 CN claimed
CN-108963389-A It is a kind of for lithium-air battery can gelling system and its preparation method and application 北京师范大学 2018-12-07 CN claimed
EP-0946183-B1 USE OF PYRIDAZINONE OR PHOSPHINE OXIDE COMPOUNDS TO TREAT OR PREVENT CARDIAC ARRHYTHMIA MERCK & CO INC (US) 2007-05-02 EP claimed
EP-0946183-A4 METHODS OF TREATING OR PREVENTING CARDIAC ARRHYTHMIA MERCK & CO INC (US) 2001-07-18 EP claimed
JP-2001503413-A 2001-03-13 JP claimed
EP-0946183-A1 METHODS OF TREATING OR PREVENTING CARDIAC ARRHYTHMIA Merck & Co., Inc. (US) 1999-10-06 EP claimed
US-5935945-A ADMINISTERING PHOSPHINE OXIDE COMPOUND WHICH BLOCKS RAPIDLY ACTIVATING DELAYED RECTIFIER POTASSIUM ION CURRENT OF THE ATRIUM MERCK & CO., INC. (US) 1999-08-10 US claimed
WO-1998018476-A1 METHODS OF TREATING OR PREVENTING CARDIAC ARRHYTHMIA MERCK & CO., INC. (US) 1998-05-07 WO claimed
CN-100364493-B9 Water absorbing agent and preparation method thereof, absorber and absorbent commodity using the water absorbing agent SDP GLOBAL Co.,Ltd. (JP) 2019-11-08 CN disclosed
CN-106165175-B High molecular electrolyte composition and polyelectrolyte membrane, film electrode composite element and the polymer electrolyte fuel cell for using it 东丽株式会社 2019-11-08 CN disclosed
CN-109983128-A Oligonucleotide composition and its method 波涛生命科学有限公司 2019-07-05 CN disclosed
CN-109761944-A A kind of chrysin amide derivatives and preparation method thereof and medical usage 武汉翼博济生生物科技有限公司 2019-05-17 CN disclosed
CN-108963389-A It is a kind of for lithium-air battery can gelling system and its preparation method and application 北京师范大学 2018-12-07 CN disclosed
CN-108962627-A A kind of supercapacitor or capacitor batteries of organic system 北京师范大学 2018-12-07 CN disclosed
EP-0946183-A4 METHODS OF TREATING OR PREVENTING CARDIAC ARRHYTHMIA MERCK & CO INC (US) 2001-07-18 EP disclosed
US-6214809-B1 ANTIARRTHYMIA AGENTS MERCK & CO., INC. 2001-04-10 US disclosed
EP-0946183-A1 METHODS OF TREATING OR PREVENTING CARDIAC ARRHYTHMIA Merck & Co., Inc. (US) 1999-10-06 EP disclosed
US-5935945-A ADMINISTERING PHOSPHINE OXIDE COMPOUND WHICH BLOCKS RAPIDLY ACTIVATING DELAYED RECTIFIER POTASSIUM ION CURRENT OF THE ATRIUM MERCK & CO., INC. (US) 1999-08-10 US disclosed
WO-1998018476-A1 METHODS OF TREATING OR PREVENTING CARDIAC ARRHYTHMIA MERCK & CO., INC. (US) 1998-05-07 WO disclosed
CN-1102648-A Substituted mono- and bipyridylmethylpyridenes BAYER AG (DE) 1995-05-17 CN disclosed