SCHEMBL9199747

SCHEMBL9199747

O=P(O)(O)OOP(=O)(O)O.[NaH].[NaH].[NaH].[NaH]

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.50
BLM P54132 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CA4 P22748 1/20 0.37
CA2 P00918 1/20 0.36
INPPL1 O15357 3/20 0.35
INPP5A Q14642 3/20 0.35
SMPD1 P17405 1/20 0.35
INPP5B P32019 1/20 0.35
ITPR3 Q14573 7/20 0.33
ITPR2 Q14571 3/20 0.33
ITPR1 Q14643 3/20 0.33
SLC34A1 Q06495 1/20 0.33
PEPD P12955 1/20 0.32
AKT1 P31749 1/20 0.32

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
SCHEMBL9016987 1.00 FDPS (0.50) FDPSBLMTDP1CA4CA2
SCHEMBL309434 0.95 FDPS (0.54) FDPSBLMTDP1CA4CA2
SCHEMBL11026871 0.91 FDPS (0.50) FDPSBLMTDP1CA4CA2
Potassium SCHEMBL6319316 0.91 FDPS (0.50) FDPSBLMTDP1CA4CA2
SCHEMBL5046798 0.91 FDPS (0.50) FDPSBLMTDP1CA4CA2
Ammonia Solution, Strong SCHEMBL3872480 0.91 FDPS (0.50) FDPSBLMTDP1CA4CA2
Calcium SCHEMBL1959843 0.91 FDPS (0.50) FDPSBLMTDP1CA4CA2
Ammonia Solution, Strong SCHEMBL5800192 0.91 FDPS (0.50) FDPSBLMTDP1CA4CA2
Ammonia Solution, Strong SCHEMBL11059149 0.87 FDPS (0.47) FDPSBLMTDP1CA4CA2
SCHEMBL5798502 0.81 SLC34A1 (0.44) FDPSBLMTDP1CA4INPPL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0279016-B2 Powdered hair dye HOYU KK (JP) 1995-04-05 EP claimed
US-4808189-A MIXTURE WITH OXIDATION COLOR DYE AND OXIDIZERRS-STORAGE HOYU CO., LTD. (JP) 1989-02-28 US claimed
EP-0279016-A2 Powdered hair dye HOYU CO., LTD. (JP) 1988-08-24 EP claimed
CN-102246712-B Method of expelling ectoparasites parasitic on breeding fish PERMELEC ELECTRODE LTD 2015-07-15 CN disclosed
CN-102246712-A Method of expelling ectoparasites parasitic on breeding fish PERMELEC ELECTRODE LTD 2011-11-23 CN disclosed
EP-0279016-B2 Powdered hair dye HOYU KK (JP) 1995-04-05 EP disclosed
US-4808189-A MIXTURE WITH OXIDATION COLOR DYE AND OXIDIZERRS-STORAGE HOYU CO., LTD. (JP) 1989-02-28 US disclosed
EP-0279016-A2 Powdered hair dye HOYU CO., LTD. (JP) 1988-08-24 EP disclosed