Phosphoric Acid Monomethyl Ester

Phosphoric Acid Monomethyl Ester

SCHEMBL4760037

COP(=O)([O-])[O-].Cc1n(C)cc[n+]1C.Cc1n(C)cc[n+]1C

nearest known ligand 0.39

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Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 4/20 0.39
APOBEC3A P31941 2/20 0.33
APOBEC3G Q9HC16 2/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ACHE P22303 2/20 0.30
POLB P06746 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30

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
Phosphoric Acid Monomethyl Ester SCHEMBL4760036 0.91 HDAC8 (0.38) HDAC8APOBEC3AAPOBEC3GKDM4ESMN1; SMN2
SCHEMBL1628843 0.91 HDAC8 (0.38) HDAC8APOBEC3AAPOBEC3GKDM4ESMN1; SMN2
SCHEMBL329129 0.80
Diethyl Hydrogen Phosphate SCHEMBL1628299 0.80 HDAC8 (0.35) HDAC8APOBEC3AAPOBEC3GKDM4ESMN1; SMN2
SCHEMBL1534053 0.79 HDAC8 (0.39) HDAC8APOBEC3AAPOBEC3GKDM4ESMN1; SMN2
Bromide SCHEMBL1537041 0.78
Water SCHEMBL3793832 0.78
Hydrochloric Acid SCHEMBL1996433 0.78
Sulfuric Acid SCHEMBL2866328 0.77 HDAC8 (0.45) HDAC8APOBEC3AAPOBEC3GKDM4ESMN1; SMN2
SCHEMBL27686412 0.76 APOBEC3A (0.43) HDAC8APOBEC3AAPOBEC3GKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008098032-A2 USE OF LIGNOCELLULOSICS SOLVATED IN IONIC LIQUIDS FOR PRODUCTION OF BIOFUELS NORTH CAROLINA STATE UNIVERSITY (US) 2008-08-14 WO disclosed
WO-2008098036-A1 PRODUCT PREPARATION AND RECOVERY FROM THERMOLYSIS OF LIGNOCELLULOSICS IN IONIC LIQUIDS NORTH CAROLINA STATE UNIVERSITY (US) 2008-08-14 WO disclosed
WO-2008098037-A2 POLYMER DERIVATIVES AND COMPOSITES FROM THE DISSOLUTION OF LIGNOCELLULOSICS IN IONIC LIQUIDS NORTH CAROLINA STATE UNIVERSITY (US) 2008-08-14 WO disclosed