SCHEMBL5858098

SCHEMBL5858098

C=CCP(=O)(OCCC#N)OCCC#N

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL5858094 0.81 ALDH1A1 (0.35) ALDH1A1NPSR1
SCHEMBL25220979 0.80 CA2 (0.32)
SCHEMBL13081648 0.74 TSHR (0.42)
SCHEMBL25644072 0.74
SCHEMBL29285234 0.74 TSHR (0.50) ALDH1A1
SCHEMBL779085 0.74 LPAR3 (0.41)
SCHEMBL4128068 0.72 LPAR2 (0.31)
SCHEMBL779257 0.72 MEN1 (0.35)
SCHEMBL11312235 0.72 LPAR2 (0.31)
SCHEMBL11309138 0.72 ALDH1A1 (0.48) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7049432-B2 Oligonucleotides having alkylphosphonate linkages and methods for their preparation ISIS PHARMACEUTICALS, INC. (US) 2006-05-23 US disclosed
US-20030078414-A1 Oligonucleotides having alkylphosphonate linkages and methods for their preparation ISIS PHARMACEUTICALS, INC. 2003-04-24 US disclosed
US-6486313-B1 Oligonucleotides having alkylphosphonate linkages and methods for their preparation ISIS PHARMACEUTICALS, INC. 2002-11-26 US disclosed
EP-1169329-A4 OLIGONUCLEOTIDES HAVING ALKYLPHOSPHONATE LINKAGES AND METHODS FOR THEIR PREPARATION ISIS PHARMACEUTICALS INC (US) 2002-07-03 EP disclosed
EP-1169329-A1 OLIGONUCLEOTIDES HAVING ALKYLPHOSPHONATE LINKAGES AND METHODS FOR THEIR PREPARATION ISIS PHARMACEUTICALS, INC. (US) 2002-01-09 EP disclosed
WO-2000049032-A1 OLIGONUCLEOTIDES HAVING ALKYLPHOSPHONATE LINKAGES AND METHODS FOR THEIR PREPARATION ISIS PHARMACEUTICALS, INC. (US) 2000-08-24 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-20030078414-A1 Oligonucleotides having alkylphosphonate linkages and methods for their preparation POLM, PPIP5K2, POLRMT ALDH1A1 4446/4885NPSR1 1976/4885

“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.