SCHEMBL54441

SCHEMBL54441

C=CCCCCCCCCCCC/C=C\CCCCCCCCCCC(O)(C[N+](C)(C)C)P(=O)(O)O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 5/20 0.38
LPAR2 Q9HBW0 4/20 0.38
GGPS1 O95749 6/20 0.36
ACLY P53396 1/20 0.36
FDPS P14324 8/20 0.33
LPAR1 Q92633 2/20 0.33
LMNA P02545 2/20 0.32
MAPT P10636 2/20 0.32
USP2 O75604 1/20 0.32
CYP3A4 P08684 1/20 0.32
RECQL P46063 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ABCC4 O15439 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
SCHEMBL53714 1.00 LPAR3 (0.38) LPAR3LPAR2GGPS1ACLYFDPS
SCHEMBL53857 1.00 LPAR3 (0.38) LPAR3LPAR2GGPS1ACLYFDPS
SCHEMBL53763 1.00 LPAR3 (0.38) LPAR3LPAR2GGPS1ACLYFDPS
SCHEMBL53966 1.00 LPAR3 (0.38) LPAR3LPAR2GGPS1ACLYFDPS
SCHEMBL53712 1.00 LPAR3 (0.38) LPAR3LPAR2GGPS1ACLYFDPS
SCHEMBL62386 1.00 LPAR3 (0.38) LPAR3LPAR2GGPS1ACLYFDPS
SCHEMBL53589 1.00 LPAR3 (0.38) LPAR3LPAR2GGPS1ACLYFDPS
SCHEMBL53709 0.99 LPAR3 (0.37) LPAR3LPAR2GGPS1ACLYFDPS
SCHEMBL53590 0.96 GGPS1 (0.36) LPAR3LPAR2GGPS1ACLYFDPS
SCHEMBL51438 0.95 LPAR3 (0.41) LPAR3LPAR2GGPS1FDPSLPAR1

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-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

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 LPAR3 55/4885LPAR2 53/4885GGPS1 208/4885

“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.