SCHEMBL4094309

SCHEMBL4094309

O=P(O)(O)C(O)(c1ccc(Cl)cc1)P(=O)(O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
HIF1A Q16665 1/20 0.54
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
PGK1 P00558 1/20 0.43
PGK2 P07205 1/20 0.43
CYP19A1 P11511 2/20 0.42
POLB P06746 1/20 0.41
MIF P14174 1/20 0.41
MMP2 P08253 1/20 0.39
MMP8 P22894 1/20 0.39
MMP14 P50281 1/20 0.39
GGPS1 O95749 1/20 0.39

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
SCHEMBL16253828 0.88 PGK1 (0.52) PGK1PGK2
SCHEMBL9496455 0.79 PGK1 (0.44) TSHRHIF1AMEN1KMT2APGK1
SCHEMBL10684331 0.77 TSHR (0.48) TSHRPGK1PGK2CYP19A1MMP8
SCHEMBL4094823 0.77 FDPS (0.53) TSHRMEN1KMT2APGK1PGK2
Water SCHEMBL5163061 0.77 PGK1 (0.43) TSHRHIF1AMEN1KMT2APGK1
SCHEMBL4095380 0.77 TSHR (0.54) TSHRMAPK1HIF1AMEN1KMT2A
SCHEMBL11773996 0.77 PGK1 (0.57) TSHRMAPK1HIF1AMEN1KMT2A
SCHEMBL3413596 0.76 PTPN1 (0.60) PGK1PGK2
SCHEMBL17534943 0.76 TSHR (0.46) TSHRMAPK1HIF1AMEN1KMT2A
SCHEMBL11212772 0.76 TSHR (0.46) TSHRMAPK1HIF1AMEN1KMT2A

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 17 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
US-4579720-A USING HYDROXYMETHANE DIPHOSPHONIC ACID PLAINS CHEMICAL DEVELOPMENT CO. (US) 1986-04-01 US disclosed
US-4440646-A HYDROXY OR HALOALKANEPHOSPHONATES PLAINS CHEMICAL DEVELOPMENT CO. (US) 1984-04-03 US disclosed
EP-0010247-B1 PHOSPHATE-FREE WASHING AGENT AND PROCESS FOR ITS PRODUCTION Henkel Kommanditgesellschaft auf Aktien (DE) 1983-03-23 EP disclosed
US-4371527-A CIRCULATING HIGH DENSITY LIPOPROTEINS AND CLEARING CHOLESTEROL SYMPHAR S.A. (CH) 1983-02-01 US disclosed
US-4309364-A Diphosphonates SYMPHAR S.A. (CH) 1982-01-05 US disclosed
EP-0036162-A1 Low-phosphate foam regulated detergent Henkel Kommanditgesellschaft auf Aktien (DE) 1981-09-23 EP disclosed
EP-0015370-A1 Diphosphonate or phosphate-phosphonate derivatives and pharmaceutical compositions containing them SYMPHAR S.A. (CH) 1980-09-17 EP disclosed
US-4188234-A STABILIZATION OF VINYL POLYMERS, POLYPHOSPHONIC ACID CHELATING AGENT, PROTECTIVE COATINGS PLAINS CHEMICAL DEVELOPMENT CO. (US) 1980-02-12 US disclosed
US-4179391-A ALUMINOSILICATES, SURFACTANTS, PHOSPHONIC ACIDS AND SALTS THEREOF, PERBORATE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 1979-12-18 US disclosed
US-4148603-A Method of washing textiles and composition containing inorganic silicates and polycarboxylates and/or polyphosphonates HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1979-04-10 US disclosed
US-4116990-A OF NON-ALKALI METAL IONS WITH PHOSPHORUS CHELATING COMPOUND PLAINS CHEMICAL DEVELOPMENT CO. (US) 1978-09-26 US disclosed
US-4020091-A TIN SALTS OF POLYPHOSPHONIC ACIDS PLAINS CHEMICAL DEVELOPMENT CO. (US) 1977-04-26 US disclosed