SCHEMBL7554692

SCHEMBL7554692

CCCCCCCC/C=C\CCCCCCCCC(O)(C(O)CO)P(=O)(O)O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 8/20 0.49
FDPS P14324 10/20 0.46
LPAR3 Q9UBY5 3/20 0.42
SMPD1 P17405 2/20 0.41
LPAR1 Q92633 2/20 0.41
MEN1 O00255 1/20 0.41
FAAH O00519 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
SOAT1 P35610 1/20 0.41
KMT2A Q03164 1/20 0.41
LPAR2 Q9HBW0 1/20 0.41

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
SCHEMBL7796960 0.91 FDPS (0.55) GGPS1FDPSLPAR3SMPD1LPAR1
SCHEMBL7549125 0.91 FDPS (0.55) GGPS1FDPSLPAR3SMPD1LPAR1
SCHEMBL4552171 0.87 GGPS1 (0.48) GGPS1FDPSLPAR3SMPD1MEN1
SCHEMBL4552690 0.87 GGPS1 (0.48) GGPS1FDPSLPAR3SMPD1MEN1
SCHEMBL1735175 0.79 MAPT (0.46) MEN1FAAHTP53CYP1A2CYP2C19
SCHEMBL7591410 0.79 MAPT (0.46) MEN1FAAHTP53CYP1A2CYP2C19
SCHEMBL16086046 0.79 MAPT (0.46) MEN1FAAHTP53CYP1A2CYP2C19
SCHEMBL5980930 0.79 MAPT (0.46) MEN1FAAHTP53CYP1A2CYP2C19
SCHEMBL7202725 0.79 MAPT (0.46) MEN1FAAHTP53CYP1A2CYP2C19
SCHEMBL4566606 0.77 FDPS (0.56) GGPS1FDPSLPAR3SMPD1LPAR1

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 GGPS1 105/4885FDPS 668/4885LPAR3 41/4885

“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.