SCHEMBL340053

SCHEMBL340053

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.40
FOLH1 Q04609 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 1/20 0.35
GABRR1 P24046 2/20 0.34
LMNA P02545 2/20 0.34
CACNA2D1 P54289 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
CACNB3 P54284 1/20 0.33
CACNA1C Q13936 1/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
PGR P06401 1/20 0.33
ADRA1A P35348 1/20 0.33
HTR2B P41595 1/20 0.33
CACNA2D2 Q9NY47 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL8646056 0.78 FOLH1 (0.48) SLC22A6FOLH1SMN1; SMN2LMNACACNA2D1
SCHEMBL2990302 0.78 FOLH1 (0.43) SLC22A6FOLH1SMN1; SMN2MAPTLMNA
SCHEMBL339801 0.77 SLC22A6 (0.36) SLC22A6FOLH1SMN1; SMN2MAPTCA2
SCHEMBL28372519 0.76 FOLH1 (0.41) SLC22A6FOLH1SMN1; SMN2MAPTLMNA
3-Hydroxybutyric Acid, (+/-)- SCHEMBL4459736 0.73 SLC22A6 (0.46) SLC22A6FOLH1SMN1; SMN2MAPTGABRR1
SCHEMBL20606601 0.73 TRPM8 (0.39) TSHRCA2
Alcohol SCHEMBL1487744 0.73 FOLH1 (0.43) SLC22A6FOLH1LMNACACNA2D1TDP1
Butane SCHEMBL7718949 0.73 FOLH1 (0.43) SLC22A6FOLH1LMNATDP1MEN1
SCHEMBL338953 0.73 FOLH1 (0.39) SLC22A6FOLH1LMNACACNA2D1TDP1
SCHEMBL338961 0.71 FOLH1 (0.42) SLC22A6FOLH1CACNA2D1CACNB3CACNA1C

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-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
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

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 2833/4885SMN1; SMN2 4525/4885

“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.