SCHEMBL754765

SCHEMBL754765

COc1ccc(C(Nc2ncnc3c2ncn3[C@H]2CC(OP(OCCC#N)N(C(C)C)C(C)C)[C@@H](COC(=O)c3ccccc3C(=O)Oc3ccccc3C#N)O2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RNMT O43148 2/20 0.32
PRKAG1 P54619 1/20 0.30
PRKAA1 Q13131 1/20 0.30
PRKAB1 Q9Y478 1/20 0.30

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
SCHEMBL753363 0.87 POLB (0.34)
SCHEMBL753549 0.86 PRKAG1 (0.31) PRKAG1PRKAA1PRKAB1
SCHEMBL733412 0.82 RNMT (0.30) RNMT
SCHEMBL29674590 0.81 TYMP (0.39) PRKAG1PRKAA1PRKAB1
SCHEMBL2054229 0.81 TYMP (0.39) PRKAG1PRKAA1PRKAB1
SCHEMBL15786367 0.81 TYMP (0.39) PRKAG1PRKAA1PRKAB1
SCHEMBL29449394 0.81 TYMP (0.39) PRKAG1PRKAA1PRKAB1
SCHEMBL9539565 0.80 TYMP (0.38) PRKAG1PRKAA1PRKAB1
SCHEMBL24354782 0.79 TYMP (0.38) PRKAG1PRKAA1PRKAB1
SCHEMBL733920 0.79 KDM4E (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138330-B2 Solid phase synthesis via deblocking immobilized nucleoside, then coupling acyl protected nucleoside phosphoramidite SIGMA-ALDRICH CO. LLC (US) 2012-03-20 US disclosed
US-8138330-B2 Solid phase synthesis via deblocking immobilized nucleoside, then coupling acyl protected nucleoside phosphoramidite SIGMA-ALDRICH CO. LLC (US) 2012-03-20 US disclosed
US-20080064867-A1 PROCESS FOR THE SYNTHESIS OF OLIGONUCLEOTIDES SIGMA ALDRICH COMPANY (US) 2008-03-13 US disclosed
US-20080064867-A1 PROCESS FOR THE SYNTHESIS OF OLIGONUCLEOTIDES SIGMA ALDRICH COMPANY (US) 2008-03-13 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-20080064867-A1 PROCESS FOR THE SYNTHESIS OF OLIGONUCLEOTIDES RNGTT, DUT, ADAR RNMT 20/4885PRKAG1 1311/4885PRKAA1 1150/4885

“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.