Phosphonic Acid

Phosphonic Acid

SCHEMBL3288015

CCCCc1cccc2ccccc12.O=[PH](O)O

nearest known ligand 0.59

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Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.48
BCHE P06276 1/20 0.47
NQO2 P16083 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
MCL1 Q07820 2/20 0.45
ACP3 P15309 1/20 0.45
CDYL Q9Y232 1/20 0.44
SIGMAR1 Q99720 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
CNR2 P34972 1/20 0.43

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
Phosphonic Acid SCHEMBL3281446 0.94 LIPG (0.50) MTNR1ABCHENQO2TDP1MCL1
Phosphonic Acid SCHEMBL3281515 0.94 LIPG (0.50) MTNR1ABCHENQO2TDP1MCL1
SCHEMBL29370232 0.89 BCHE (0.54) MTNR1ABCHENQO2SIGMAR1CYP1A2
SCHEMBL74016 0.89 BCHE (0.54) MTNR1ABCHENQO2SIGMAR1CYP1A2
SCHEMBL2586601 0.88 BCHE (0.52) MTNR1ABCHENQO2SIGMAR1CYP1A2
Phosphine SCHEMBL28240080 0.88 BCHE (0.52) MTNR1ABCHENQO2SIGMAR1CYP1A2
SCHEMBL2586600 0.88 BCHE (0.52) MTNR1ABCHENQO2SIGMAR1CYP1A2
Sulfuric Acid SCHEMBL7785118 0.87 NQO2 (0.54) MTNR1ABCHENQO2TDP1MCL1
Methane SCHEMBL27919120 0.86 BCHE (0.51) MTNR1ABCHENQO2SIGMAR1CYP1A2
Sulfuric Acid SCHEMBL1945293 0.85 NQO2 (0.53) MTNR1ABCHENQO2TDP1MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7704939-B2 Surfactant SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2010-04-27 US disclosed
US-20070167343-A1 neutralized salt including alkylbenzenesulphonates (toluenesulfonic acid guanidine salt, toluenesulfonic acid DBU salt, toluenesulfonic acid DBN salt) for cleaning electonics SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2007-07-19 US disclosed