Methyl Phosphonate

Methyl Phosphonate

SCHEMBL2455377

CC[n+]1ccccc1.CP(=O)([O-])O

nearest known ligand 0.38

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GGPS1 O95749 5/20 0.36
▸ KMT2A Q03164 3/20 0.35
▸ CHRM2 P08172 2/20 0.34
▸ ADRA2A P08913 2/20 0.34
▸ ADORA3 P0DMS8 2/20 0.34
▸ CHRM1 P11229 2/20 0.34
▸ ACHE P22303 2/20 0.34
▸ SLC6A2 P23975 2/20 0.34
▸ SLC6A4 P31645 2/20 0.34
▸ SLC6A3 Q01959 2/20 0.34
▸ ABCB11 O95342 1/20 0.34
▸ ESR1 P03372 1/20 0.34
▸ PGR P06401 1/20 0.34
▸ HTR1A P08908 1/20 0.34
▸ DRD1 P21728 1/20 0.34
▸ TBXA2R P21731 1/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ PDE4A P27815 1/20 0.34
▸ ADRA1A P35348 1/20 0.34
▸ OPRM1 P35372 1/20 0.34

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
SCHEMBL2229286 0.84 ACHE (0.35) KMT2ACHRM2ADRA2AADORA3CHRM1
Bicarbonate SCHEMBL10812331 0.79 KMT2A (0.43) KMT2ACHRM2ADRA2AADORA3CHRM1
Bicarbonate SCHEMBL10812328 0.79 KMT2A (0.43) KMT2ACHRM2ADRA2AADORA3CHRM1
SCHEMBL2451536 0.79 CHRM2 (0.32) KMT2ACHRM2ADRA2AADORA3CHRM1
SCHEMBL1725286 0.78 ACHE (0.48) KMT2ACHRM2ADRA2AADORA3CHRM1
SCHEMBL98339 0.78 — —
Clodronic Acid SCHEMBL9193655 0.78 KMT2A (0.36) GGPS1KMT2ACHRM2ADRA2AADORA3
Clodronic Acid SCHEMBL9193652 0.78 KMT2A (0.32) KMT2ACHRM2ADRA2AADORA3CHRM1
Acetic Acid SCHEMBL2451694 0.77 KMT2A (0.42) KMT2ACHRM2ADRA2AADORA3CHRM1
Methyl Phosphonate SCHEMBL2452244 0.76 GGPS1 (0.33) GGPS1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2547822-B1 PROCESS FOR FIBRILLATING LIGNOCELLULOSIC MATERIAL, FIBRES AND THEIR USE UNIV HELSINKI (FI) 2014-07-02 — — EP disclosed
US-20130056165-A1 PROCESS FOR FIBRILLATING LIGNOCELLULOSIC MATERIAL, FIBRES AND THEIR USE UNIVERSITY OF HELSINKI (FI) 2013-03-07 — — US disclosed
EP-2547822-A1 PROCESS FOR FIBRILLATING LIGNOCELLULOSIC MATERIAL, FIBRES AND THEIR USE University Of Helsinki (FI) 2013-01-23 — — EP disclosed
WO-2011114004-A1 PROCESS FOR FIBRILLATING LIGNOCELLULOSIC MATERIAL, FIBRES AND THEIR USE UNIVERSITY OF HELSINKI (FI) 2011-09-22 — — WO disclosed
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