SCHEMBL4099292

SCHEMBL4099292

O=P(O)(O)C(Cl)(c1ccccc1)P(=O)(O)O

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.58
PGK1 P00558 5/20 0.54
PGK2 P07205 5/20 0.54
CYP1A2 P05177 1/20 0.48
TSHR P16473 1/20 0.46
PTPN5 P54829 2/20 0.46
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CA5A P35218 1/20 0.42
FDPS P14324 1/20 0.42
SRC P12931 2/20 0.38
CFTR P13569 1/20 0.38

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
Water SCHEMBL5162861 0.98 PTPN1 (0.56) PTPN1PGK1PGK2CYP1A2TSHR
SCHEMBL3974479 0.90 PTPN1 (0.48) PTPN1PGK1PGK2CYP1A2TSHR
SCHEMBL2150771 0.81 PGK1 (0.72) PTPN1PGK1PGK2CYP1A2TSHR
SCHEMBL4095380 0.79 TSHR (0.54) PGK1PGK2TSHRPTPN5
SCHEMBL10040014 0.77 PTPN1 (0.54) PTPN1PGK1PGK2CYP1A2TSHR
SCHEMBL14029153 0.77 TSHR (0.46) PGK1PGK2TSHRPTPN5
SCHEMBL1766233 0.75 PTPN1 (0.62) PTPN1PGK1PGK2CYP1A2PTPN5
SCHEMBL9648116 0.75 PTPN1 (0.62) PTPN1PGK1PGK2CYP1A2PTPN5
SCHEMBL10859325 0.75 PTPN1 (0.62) PTPN1PGK1PGK2CYP1A2PTPN5
SCHEMBL3413596 0.73 PTPN1 (0.60) PTPN1PGK1PGK2CYP1A2PTPN5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2057303-B1 CHROMIUM-FREE, THERMALLY CURABLE CORROSION PROTECTION COMPOSITION HENKEL AG & CO KGAA (DE) 2012-05-23 EP disclosed
US-20090214883-A1 CHROMIUM-FREE, THERMALLY CURABLE CORROSION PROTECTION COMPOSITION HENKEL AG & CO. KGAA (DE) 2009-08-27 US disclosed
EP-1658392-B1 COLOUR CONVERSION LAYERS ON METAL SURFACES HENKEL KGAA (DE) 2007-03-14 EP disclosed
EP-1658392-A1 COLOUR CONVERSION LAYERS ON METAL SURFACES Henkel Kommanditgesellschaft auf Aktien (DE) 2006-05-24 EP disclosed
WO-2005021834-A1 COLOUR CONVERSION LAYERS ON METAL SURFACES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-03-10 WO disclosed
EP-1187883-A1 CHROMIUM-FREE ANTICORROSIVE AND ANTICORROSIVE METHOD Henkel Kommanditgesellschaft auf Aktien (DE) 2002-03-20 EP disclosed
WO-2000071626-A1 CHROMIUM-FREE ANTICORROSIVE AND ANTICORROSIVE METHOD HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-11-30 WO disclosed
US-4252857-A Flameproofing substrate BAYER AKTIENGESELLSCHAFT (DE) 1981-02-24 US disclosed
US-4246103-A INHIBIT PRECIPITATION OF HARD WATER IONS ESPECIALLY FOR INDUSTRIAL WATER AND SLUDGE BAYER AKTIENGESELLSCHAFT (DE) 1981-01-20 US disclosed