SCHEMBL7550150

SCHEMBL7550150

CCCCCCCC/C=C\CCCCCCCCNCCCOP(=O)(O)O

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 11/20 0.73
LPAR2 Q9HBW0 9/20 0.71
LPAR1 Q92633 7/20 0.71
ENPP2 Q13822 1/20 0.63
S1PR2 O95136 5/20 0.50
S1PR4 O95977 5/20 0.50
S1PR1 P21453 5/20 0.50
S1PR3 Q99500 5/20 0.50
S1PR5 Q9H228 1/20 0.50

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
SCHEMBL7116031 0.97 LPAR3 (0.77) LPAR3LPAR2LPAR1ENPP2S1PR2
SCHEMBL8438271 0.97 LPAR3 (0.77) LPAR3LPAR2LPAR1ENPP2S1PR2
SCHEMBL8438260 0.97 LPAR3 (0.77) LPAR3LPAR2LPAR1ENPP2S1PR2
SCHEMBL7548385 0.97 LPAR3 (0.77) LPAR3LPAR2LPAR1ENPP2S1PR2
SCHEMBL7124930 0.97 LPAR3 (0.77) LPAR3LPAR2LPAR1ENPP2S1PR2
SCHEMBL11419750 0.90 LPAR3 (0.67) LPAR3LPAR2LPAR1ENPP2S1PR2
SCHEMBL7216135 0.88 LPAR3 (0.65) LPAR3LPAR2LPAR1ENPP2S1PR1
Diethanolamine SCHEMBL3471209 0.88 LPAR3 (0.72) LPAR3LPAR2LPAR1ENPP2
Diethanolamine SCHEMBL3471215 0.88 LPAR3 (0.72) LPAR3LPAR2LPAR1ENPP2
Phosphoric Acid Monododecyl Ester SCHEMBL8438347 0.87 LPAR3 (0.78) LPAR3LPAR2LPAR1ENPP2S1PR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020173489-A1 COMPOSITIONS CONTAINING A MIXTURE OF PHOSPHOROUS COMPOUNDS AND ALKYLGLYCEROLS MAX-PLANCK-GESSELSCHAFT ZUR FORDERUNG DER WISSENSCHAFTER E.V. (DE) 2002-11-21 US disclosed
US-5916884-A CYTOTOXIC THERAPEUTIC COMPOUND; ANTITUMOR AGENT MAX-PLANCK-GESELLSCHAFT ZUR FOEDERUNG DER WISSENSCHAFTEN (DE) 1999-06-29 US disclosed
EP-0916343-A1 use of alkzl phosphoric acid compounds for the treatment of psoriatic diseases ASTA Medica Aktiengesellschaft (DE) 1999-05-19 EP disclosed
US-5290769-A Applying compositions for skin disorders ASTA PHARMA AKTIENGESELLSCHAFT (DE) 1994-03-01 US disclosed
EP-0248062-B1 MEDICAMENTS Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1992-05-06 EP disclosed
EP-0419998-A2 Use of alkylphosphonic acid derivatives for the treatment of psoriasis ASTA Medica Aktiengesellschaft (DE) 1991-04-03 EP disclosed
EP-0225608-A2 Medicine Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1987-06-16 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-20020173489-A1 COMPOSITIONS CONTAINING A MIXTURE OF PHOSPHOROUS COMPOUNDS AND ALKYLGLYCEROLS PHOSPHO1, PLCG2, PPIP5K2 LPAR3 41/4885LPAR2 65/4885LPAR1 69/4885

“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.