SCHEMBL339910

SCHEMBL339910

CCCCCP(=O)(O)C(C)C(C)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 3/20 0.45
LPAR2 Q9HBW0 1/20 0.45
TRPM8 Q7Z2W7 10/20 0.44

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
SCHEMBL339477 0.98 LPAR3 (0.48) LPAR3LPAR2TRPM8
SCHEMBL338997 0.94 TRPM8 (0.39) LPAR3LPAR2TRPM8
SCHEMBL339954 0.86 ANPEP (0.33)
SCHEMBL1036993 0.79 LPAR3 (0.52) LPAR3LPAR2TRPM8
SCHEMBL339956 0.79 PPARD (0.33)
SCHEMBL338687 0.78 ANPEP (0.35)
SCHEMBL17626440 0.76 TRPM8 (0.60) LPAR3LPAR2TRPM8
SCHEMBL1315919 0.75 TRPM8 (0.42) LPAR3LPAR2TRPM8
SCHEMBL340078 0.74 TRPM8 (0.46) LPAR3LPAR2TRPM8
SCHEMBL5955984 0.74 TRPM8 (0.61) LPAR3LPAR2TRPM8

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 LPAR3 640/4885LPAR2 843/4885TRPM8 4207/4885

“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.