SCHEMBL3045079

SCHEMBL3045079

CCC/C=C/CCCCO[C]=O

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 6/20 0.42
LPAR2 Q9HBW0 5/20 0.42
LPAR1 Q92633 3/20 0.42
FAAH O00519 2/20 0.39
TRPV1 Q8NER1 1/20 0.39

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
SCHEMBL3029528 1.00 LPAR3 (0.42) LPAR3LPAR2LPAR1FAAHTRPV1
SCHEMBL2889638 0.90 FAAH (0.52) LPAR3LPAR2LPAR1FAAHTRPV1
SCHEMBL3035571 0.86 LPAR2 (0.53) LPAR3LPAR2LPAR1FAAHTRPV1
SCHEMBL3031132 0.86 LPAR2 (0.53) LPAR3LPAR2LPAR1FAAHTRPV1
SCHEMBL3035566 0.85 LPAR3 (0.44) LPAR3LPAR2LPAR1FAAHTRPV1
SCHEMBL3035329 0.85 LPAR3 (0.44) LPAR3LPAR2LPAR1FAAHTRPV1
SCHEMBL7483913 0.85 ALDH1A1 (0.32) LPAR3
SCHEMBL7483917 0.85 ALDH1A1 (0.32) LPAR3
SCHEMBL3024625 0.83 FAAH (0.48) LPAR3FAAHTRPV1
SCHEMBL3042596 0.83 FAAH (0.48) LPAR3FAAHTRPV1

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-20100216736-A2 2'-CYANOPYRIMIDINE NUCLEOSIDE COMPOUND TAIHO PHARMACEUTICAL CO., LTD. (JP) 2010-08-26 US disclosed
US-20100056466-A1 2'-Cyanopyrimidine Nucleoside Compound MATSUDA, AKIRA (JP) 2010-03-04 US disclosed
EP-2045256-A1 2'-CYANOPYRIMIDINE NUCLEOSIDE COMPOUND TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 2009-04-08 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 (2 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-20100216736-A2 2'-CYANOPYRIMIDINE NUCLEOSIDE COMPOUND NUDT1, DPYD, SLC29A1 LPAR3 2306/4885LPAR2 2934/4885LPAR1 2368/4885
US-20100056466-A1 2'-Cyanopyrimidine Nucleoside Compound NUDT1, DPYD, SLC29A1 LPAR3 2306/4885LPAR2 2934/4885LPAR1 2368/4885

“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.