SCHEMBL339801

SCHEMBL339801

CCC(CC(=O)O)P(=O)(O)C(C)O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.36
FOLH1 Q04609 1/20 0.35
MMP1 P03956 2/20 0.34
MMP2 P08253 2/20 0.34
MMP3 P08254 1/20 0.34
GPR84 Q9NQS5 4/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
MMP8 P22894 1/20 0.31
CA9 Q16790 1/20 0.31

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
SCHEMBL2976107 0.79 FOLH1 (0.40) SLC22A6FOLH1MMP1MMP2MMP3
SCHEMBL8781578 0.79 FOLH1 (0.45) SLC22A6FOLH1MMP1MMP2MMP3
SCHEMBL340053 0.77 SLC22A6 (0.40) SLC22A6FOLH1GPR84SMN1; SMN2MAPT
Butane SCHEMBL7715957 0.75 FOLH1 (0.42) FOLH1GPR84CA2
SCHEMBL339100 0.75 FOLH1 (0.38) SLC22A6FOLH1MMP1MMP2MMP3
SCHEMBL339732 0.74 FOLH1 (0.38) FOLH1MMP1MMP2MMP3
SCHEMBL2982763 0.72 SLC22A6 (0.35) SLC22A6FOLH1MMP1MMP2GPR84
SCHEMBL339643 0.72 FOLH1 (0.35) SLC22A6FOLH1MMP1MMP2GPR84
SCHEMBL339393 0.71 ACP3 (0.42) MAPT
SCHEMBL339802 0.71 PPARD (0.35) SLC22A6FOLH1MMP1MMP2CA12

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
US-8097753-B2 Mixtures composed or monocarboxy-functionalized dialkylphosphinic acids, their use and a process for their preparation CLARIANT FINANCE (BVI) LIMITED (VG) 2012-01-17 US disclosed
EP-1832594-B1 Compounds of mono-carboxyl functionalised dialkylphosphine acid salts, a method for their manufacture and their application CLARIANT FINANCE BVI LTD (VG) 2011-05-18 EP disclosed
US-20070213436-A1 Mixtures composed or monocarboxy-functionalized dialkylphosphinic acids, their use and a process for their preparation CLARIANT INTERNATIONAL LTD 2007-09-13 US disclosed
EP-1832594-A1 Compounds of mono-carboxyl functionalised dialkylphosphine acid salts, a method for their manufacture and their application CLARIANT INTERNATIONAL LTD. (CH) 2007-09-12 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070213436-A1 Mixtures composed or monocarboxy-functionalized dialkylphosphinic acids, their use and a process for their preparation PAH, ALKBH3, FTO SLC22A6 1553/4885FOLH1 2833/4885MMP1 2850/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.