SCHEMBL2584744

SCHEMBL2584744

COC(=O)OC[C@@H]1C[C@@H](OC(C)=O)[C@H](n2cnc3ncnc-3c2NC(=O)c2ccccc2)O1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.35
ACACB O00763 2/20 0.33
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
ACHE P22303 1/20 0.32
DNPH1 O43598 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PRKAB2 O43741 1/20 0.30
PRKAG1 P54619 1/20 0.30
PRKAA2 P54646 1/20 0.30
PRKAA1 Q13131 1/20 0.30
PRKAG3 Q9UGI9 1/20 0.30
PRKAG2 Q9UGJ0 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
SCHEMBL2583650 0.94 PRMT6 (0.35) PRMT6ACACBKDM4EPOLBPRKAB2
SCHEMBL2585211 0.83 ACHE (0.30) ACHEPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL2578077 0.83 ACHE (0.34) ACHEPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL2584381 0.81 PRKAB2 (0.31) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL2582443 0.78 PRKAB2 (0.50) PRMT6POLBACHEMEN1KMT2A
SCHEMBL2580989 0.77 LMNA (0.35) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL2580396 0.75 LMNA (0.39) ACHEPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL2581382 0.75 ALDH1A1 (0.33) ACHE
SCHEMBL2586052 0.74 PRKAB2 (0.44) PRMT6PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL2586123 0.74 ALDH1A1 (0.34) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3

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-10100076-B2 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation GILEAD PHARMASSET LLC (US) 2018-10-16 US disclosed
US-20140057863-A1 MODIFIED NUCLEOSIDES FOR THE TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION GILEAD SCIENCES, INC. (US) 2014-02-27 US disclosed
EP-2251015-B1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation GILEAD PHARMASSET LLC (US) 2013-02-20 EP disclosed
US-20110269707-A1 Modified nucleosides for the treatment of viral infections and abnormal cellullar proliferation PHARMASSET, INC. 2011-11-03 US disclosed
EP-2251015-A1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation Pharmasset, Inc. (US) 2010-11-17 EP disclosed
US-20030087873-A1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation PHARMASSET, INC. 2003-05-08 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 (4 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-20140057863-A1 MODIFIED NUCLEOSIDES FOR THE TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION SLC29A1, PNP, SLC29A2 PRMT6 3652/4885ACACB 4363/4885KDM4E 2698/4885
US-20110269707-A1 Modified nucleosides for the treatment of viral infections and abnormal cellullar proliferation PNP, ALPP, XDH PRMT6 4213/4885ACACB 2768/4885KDM4E 2998/4885
US-10100076-B2 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation SLC29A1, SLC29A2, PNP PRMT6 3538/4885ACACB 4309/4885KDM4E 3226/4885
US-20030087873-A1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation SLC29A1, PNP, SLC29A2 PRMT6 3615/4885ACACB 4294/4885KDM4E 2945/4885

“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.