SCHEMBL52614

SCHEMBL52614

CCCCCCCCCCCCCCCCCCCC/C=C\CCC(O)(C[N+](C)(C)C)P(=O)(O)O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 8/20 0.51
FDPS P14324 9/20 0.45
LPAR3 Q9UBY5 2/20 0.44
MEN1 O00255 1/20 0.44
FAAH O00519 1/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44
SOAT1 P35610 1/20 0.44
KMT2A Q03164 1/20 0.44
LPAR1 Q92633 1/20 0.43
LPAR2 Q9HBW0 1/20 0.43
FABP3 P05413 4/20 0.42

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
SCHEMBL52096 1.00 GGPS1 (0.51) GGPS1FDPSLPAR3MEN1FAAH
SCHEMBL62429 1.00 GGPS1 (0.51) GGPS1FDPSLPAR3MEN1FAAH
SCHEMBL53243 1.00 GGPS1 (0.51) GGPS1FDPSLPAR3MEN1FAAH
SCHEMBL54965 1.00 GGPS1 (0.51) GGPS1FDPSLPAR3MEN1FAAH
SCHEMBL53066 1.00 GGPS1 (0.51) GGPS1FDPSLPAR3MEN1FAAH
SCHEMBL54648 1.00 GGPS1 (0.51) GGPS1FDPSLPAR3MEN1FAAH
SCHEMBL53251 1.00 GGPS1 (0.51) GGPS1FDPSLPAR3MEN1FAAH
SCHEMBL53332 1.00 GGPS1 (0.51) GGPS1FDPSLPAR3MEN1FAAH
SCHEMBL53131 1.00 GGPS1 (0.51) GGPS1FDPSLPAR3MEN1FAAH
SCHEMBL53215 1.00 GGPS1 (0.51) GGPS1FDPSLPAR3MEN1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129552-B2 for transporting drugs or as gene transport vehicles, as solubilizers for drugs of low solubility in water, and themselves as active ingredients against diseases such as cancer or leishmaniosis; (Z)-6-octadecenyl-1-phospho-N,N,N-trimethylpropylammonium MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2012-03-06 US disclosed
US-20080214849-A1 PHOSPHOLIPIDS WITH UNSATURATED ALKYL AND ACYL CHAINS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSHAFTEN E.V. (DE) 2008-09-04 US disclosed
EP-1102775-B1 NOVEL PHOSPHOLIPIDS WITH UNSATURATED ALKYL AND ACYL CHAINS MAX PLANCK GESELLSCHAFT (DE) 2005-06-08 EP disclosed
EP-1102775-A1 NOVEL PHOSPHOLIPIDS WITH UNSATURATED ALKYL AND ACYL CHAINS Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2001-05-30 EP disclosed
WO-2000008031-A1 NOVEL PHOSPHOLIPIDS WITH UNSATURATED ALKYL AND ACYL CHAINS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2000-02-17 WO 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-20080214849-A1 PHOSPHOLIPIDS WITH UNSATURATED ALKYL AND ACYL CHAINS PHOSPHO1, PLTP, SGMS1 GGPS1 208/4885FDPS 425/4885LPAR3 55/4885

“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.