SCHEMBL51687

SCHEMBL51687

C=CCCCCCCCCCCCCCCCCOP(=O)(O)C(CC)[N+](C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 15/20 0.55
LPAR2 Q9HBW0 9/20 0.55
LPAR1 Q92633 8/20 0.41
TSHR P16473 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
P2RY10 O00398 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
SCHEMBL53516 1.00 LPAR3 (0.55) LPAR3LPAR2LPAR1TSHRALDH1A1
SCHEMBL53103 1.00 LPAR3 (0.55) LPAR3LPAR2LPAR1TSHRALDH1A1
SCHEMBL52928 1.00 LPAR3 (0.55) LPAR3LPAR2LPAR1TSHRALDH1A1
SCHEMBL52988 1.00 LPAR3 (0.55) LPAR3LPAR2LPAR1TSHRALDH1A1
SCHEMBL54021 1.00 LPAR3 (0.55) LPAR3LPAR2LPAR1TSHRALDH1A1
SCHEMBL52964 1.00 LPAR3 (0.55) LPAR3LPAR2LPAR1TSHRALDH1A1
SCHEMBL52947 1.00 LPAR3 (0.55) LPAR3LPAR2LPAR1TSHRALDH1A1
SCHEMBL53597 0.96 LPAR3 (0.51) LPAR3LPAR2LPAR1LMNAP2RY10
SCHEMBL6429344 0.96 LPAR3 (0.51) LPAR3LPAR2LPAR1LMNAP2RY10
SCHEMBL54863 0.96 LPAR3 (0.51) LPAR3LPAR2LPAR1LMNAP2RY10

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 3 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

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 53/4885LPAR1 48/4885

“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.