SCHEMBL17294015

SCHEMBL17294015

Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NCCCCCC(=O)N2CCNCCNCCNCC2)[C@@H](O)[C@H]1O

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PRKACA P17612 7/20 0.75
▸ ROCK2 O75116 1/20 0.75
▸ METTL3 Q86U44 1/20 0.68
▸ METTL14 Q9HCE5 1/20 0.68
▸ HSP90B1 P14625 1/20 0.67
▸ AHCY P23526 1/20 0.67

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
SCHEMBL17294035 1.00 PRKACA (0.75) PRKACAROCK2METTL3METTL14HSP90B1
SCHEMBL17294023 0.99 PRKACA (0.73) PRKACAROCK2METTL3METTL14HSP90B1
SCHEMBL17293999 0.99 PRKACA (0.73) PRKACAROCK2METTL3METTL14HSP90B1
SCHEMBL17297714 0.99 PRKACA (0.73) PRKACAROCK2METTL3METTL14HSP90B1
SCHEMBL17294024 0.97 PRKACA (0.70) PRKACAROCK2METTL3METTL14HSP90B1
SCHEMBL17294000 0.97 PRKACA (0.69) PRKACAROCK2METTL3METTL14HSP90B1
SCHEMBL18767580 0.95 PRKACA (0.70) PRKACAROCK2METTL3METTL14HSP90B1
SCHEMBL17294012 0.94 ADORA3 (0.69) PRKACAROCK2METTL3METTL14HSP90B1
Trifluoromethanesulfonic Acid SCHEMBL17293997 0.92 PRKACA (0.64) PRKACAROCK2METTL3METTL14HSP90B1
Trifluoromethanesulfonic Acid SCHEMBL18730564 0.92 PRKACA (0.64) PRKACAROCK2METTL3METTL14HSP90B1

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-10077284-B2 UBA5 inhibitors THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2018-09-18 — — US disclosed
US-20170107247-A1 UBA5 INHIBITORS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2017-04-20 — — US disclosed
US-20170107247-A1 UBA5 INHIBITORS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2017-04-20 — — US disclosed
US-20170107247-A1 UBA5 INHIBITORS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2017-04-20 — — US disclosed
WO-2015179955-A1 UBA5 INHIBITORS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2015-12-03 — — WO disclosed
WO-2015179955-A1 UBA5 INHIBITORS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2015-12-03 — — 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 (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-10077284-B2 UBA5 inhibitors UBQLN2, UBTF, UBQLN1 PRKACA 2626/4885ROCK2 3602/4885METTL3 2122/4885
US-20170107247-A1 UBA5 INHIBITORS UBQLN2, UBTF, UBQLN1 PRKACA 2626/4885ROCK2 3602/4885METTL3 2122/4885

“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.

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