SCHEMBL5874470

SCHEMBL5874470

CCCC[N+](CCCC)(CCCC)S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 3/20 0.41
TP53 P04637 1/20 0.37
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
SLC22A2 O15244 1/20 0.35
DNM1 Q05193 2/20 0.35
EPHX1 P07099 1/20 0.34
PPARA Q07869 2/20 0.33
CA12 O43570 1/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 0.33
ENPP2 Q13822 1/20 0.32
FAAH O00519 1/20 0.32

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
SCHEMBL5874546 0.83 SLC22A1 (0.35) SLC22A1TP53ENPP2
Betaine SCHEMBL23723254 0.82 TSHR (0.50) PPARAENPP2
Tetrabuthylammonium SCHEMBL243899 0.76 SLC22A1 (0.67) SLC22A1TP53CA1CA2SLC22A2
Tetrabuthylammonium SCHEMBL27990806 0.76 SLC22A1 (0.67) SLC22A1TP53CA1CA2SLC22A2
Tetrabuthylammonium SCHEMBL331036 0.74 SLC22A1 (0.63) SLC22A1TP53CA1CA2SLC22A2
Tetrabuthylammonium SCHEMBL20550034 0.74 SLC22A1 (0.63) SLC22A1TP53CA1CA2SLC22A2
Propane SCHEMBL11244315 0.74 MEN1 (0.33) DNM1
Tetrabuthylammonium SCHEMBL331004 0.74 SLC22A1 (0.63) SLC22A1TP53CA1CA2SLC22A2
Tributylmethylammonium SCHEMBL1627727 0.74 TP53 (0.41) SLC22A1TP53CA1CA2SLC22A2
Tetrabuthylammonium SCHEMBL9998667 0.74 SLC22A1 (0.63) SLC22A1TP53CA1CA2SLC22A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230339850-A1 CANNABINOID SULFATE ESTERS, THEIR SALTS AND USES THEREOF LONDON PHARMACEUTICALS AND RESEARCH CORPORATION (CA) 2023-10-26 US claimed
EP-4100399-A1 CANNABINOID SULFATE ESTERS, THEIR SALTS AND USES THEREOF London Pharmaceuticals and Research Corporation (CA) 2022-12-14 EP claimed
EP-4301762-A1 SYNERGISTIC CANNABINOID ESTERS, THEIR SALTS AND USES THEREOF London Pharmaceuticals and Research Corporation (CA) 2024-01-10 EP disclosed
US-20230339850-A1 CANNABINOID SULFATE ESTERS, THEIR SALTS AND USES THEREOF LONDON PHARMACEUTICALS AND RESEARCH CORPORATION (CA) 2023-10-26 US disclosed
EP-4100399-A1 CANNABINOID SULFATE ESTERS, THEIR SALTS AND USES THEREOF London Pharmaceuticals and Research Corporation (CA) 2022-12-14 EP disclosed
WO-2022183292-A1 SYNERGISTIC CANNABINOID ESTERS, THEIR SALTS AND USES THEREOF LONDON PHARMACEUTICALS AND RESEARCH CORPORATION (CA) 2022-09-09 WO disclosed
US-7128976-B2 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2006-10-31 US disclosed
US-20030091838-A1 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2003-05-15 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-20230339850-A1 CANNABINOID SULFATE ESTERS, THEIR SALTS AND USES THEREOF CNR2, CNR1, GPR18 SLC22A1 829/4885TP53 2917/4885CA1 4528/4885

“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.