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SCHEMBL4435888

SCHEMBL4435888

O=S(=O)(O)c1cc(O)c2c(O)c(N=Nc3ccccc3[As](=O)(O)O)c(S(=O)(=O)O)cc2c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 4/20 0.72
▸ CYP2C9 P11712 3/20 0.70
▸ MAPK1 P28482 2/20 0.70
▸ DNASE1L3 Q13609 1/20 0.70
▸ PRMT1 Q99873 1/20 0.68
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ HTT P42858 1/20 0.49
▸ FUT8 Q9BYC5 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.47
▸ HIF1A Q16665 3/20 0.47
▸ ENPP2 Q13822 5/20 0.47
▸ PHLPP2 Q6ZVD8 2/20 0.47
▸ POLB P06746 1/20 0.45
▸ GRK2 P25098 1/20 0.45
▸ PLEC Q15149 1/20 0.45
▸ THRB P10828 2/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ CYP2C19 P33261 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44

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
SCHEMBL29425671 1.00 CYP1A2 (0.72) CYP1A2CYP2C9MAPK1DNASE1L3PRMT1
SCHEMBL8651840 1.00 CYP1A2 (0.72) CYP1A2CYP2C9MAPK1DNASE1L3PRMT1
SCHEMBL17580714 1.00 CYP1A2 (0.72) CYP1A2CYP2C9MAPK1DNASE1L3PRMT1
SCHEMBL11753324 0.99 CYP1A2 (0.70) CYP1A2CYP2C9MAPK1DNASE1L3PRMT1
SCHEMBL20816434 0.99 CYP1A2 (0.70) CYP1A2CYP2C9MAPK1DNASE1L3PRMT1
SCHEMBL17580711 0.99 CYP1A2 (0.70) CYP1A2CYP2C9MAPK1DNASE1L3PRMT1
SCHEMBL31404923 0.99 CYP1A2 (0.70) CYP1A2CYP2C9MAPK1DNASE1L3PRMT1
SCHEMBL1527663 0.90 CYP1A2 (0.56) CYP1A2CYP2C9MAPK1DNASE1L3PRMT1
SCHEMBL1527662 0.90 CYP1A2 (0.56) CYP1A2CYP2C9MAPK1DNASE1L3PRMT1
SCHEMBL9276563 0.90 CYP1A2 (0.69) CYP1A2CYP2C9MAPK1DNASE1L3PRMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0597900-B1 COLORIMETRIC DETERMINATION OF MAGNESIUM IONS IN FLUIDS SEBA DIAGNOSTICS PTY LTD (AU) 1998-01-07 — — EP claimed
EP-0597900-A4 — — 1994-08-31 — — EP claimed
EP-0597900-A1 COLORIMETRIC DETERMINATION OF MAGNESIUM IONS IN FLUIDS SEBA DIAGNOSTICS PTY. LTD. (AU) 1994-05-25 — — EP claimed
WO-1993003100-A1 COLORIMETRIC DETERMINATION OF MAGNESIUM IONS IN FLUIDS SEBA DIAGNOSTICS PTY. LTD. (AU) 1993-02-18 — — WO claimed
EP-2092048-A1 LAUNDRY DETERGENT COMPOSITION Unilever PLC (GB) 2009-08-26 — — EP disclosed
WO-2008074635-A1 LAUNDRY DETERGENT COMPOSITION UNILEVER PLC (GB) 2008-06-26 — — WO disclosed
US-5790627-A Method and apparatus for observing a specimen using an X-ray microscope RESEARCH DEVELOPMENT CORP. (JP) 1998-08-04 — — US disclosed
EP-0597900-B1 COLORIMETRIC DETERMINATION OF MAGNESIUM IONS IN FLUIDS SEBA DIAGNOSTICS PTY LTD (AU) 1998-01-07 — — EP disclosed
EP-0597900-B1 COLORIMETRIC DETERMINATION OF MAGNESIUM IONS IN FLUIDS SEBA DIAGNOSTICS PTY LTD (AU) 1998-01-07 — — EP disclosed
EP-0597900-A4 — — 1994-08-31 — — EP disclosed
EP-0597900-A4 — — 1994-08-31 — — EP disclosed
EP-0597900-A1 COLORIMETRIC DETERMINATION OF MAGNESIUM IONS IN FLUIDS SEBA DIAGNOSTICS PTY. LTD. (AU) 1994-05-25 — — EP disclosed
EP-0597900-A1 COLORIMETRIC DETERMINATION OF MAGNESIUM IONS IN FLUIDS SEBA DIAGNOSTICS PTY. LTD. (AU) 1994-05-25 — — EP disclosed
WO-1993003100-A1 COLORIMETRIC DETERMINATION OF MAGNESIUM IONS IN FLUIDS SEBA DIAGNOSTICS PTY. LTD. (AU) 1993-02-18 — — WO disclosed
WO-1993003100-A1 COLORIMETRIC DETERMINATION OF MAGNESIUM IONS IN FLUIDS SEBA DIAGNOSTICS PTY. LTD. (AU) 1993-02-18 — — WO disclosed
US-4361842-A INK JET CANON KABUSHIKI KAISHA (JP) 1982-11-30 — — US disclosed