SCHEMBL716284

SCHEMBL716284

CC(=O)N[C@@H]1CCN(c2nc3c(C)c(F)ccc3cc2[C@H](C)Nc2nc(C)nc(N)n2)C1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 8/20 0.41
SMPD3 Q9NY59 4/20 0.39
DYRK3 O43781 1/20 0.38
PIM3 Q86V86 1/20 0.38
SRPK1 Q96SB4 1/20 0.38
CSNK1G1 Q9HCP0 1/20 0.38
AKT1 P31749 1/20 0.37
ACACB O00763 1/20 0.37
ADORA2B P29275 3/20 0.36
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 1/20 0.36
KRAS P01116 1/20 0.36
SOS1 Q07889 1/20 0.36

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
SCHEMBL716285 1.00 OPRK1 (0.41) OPRK1SMPD3DYRK3PIM3SRPK1
SCHEMBL713435 0.90 AKT1 (0.42) OPRK1SMPD3DYRK3PIM3SRPK1
SCHEMBL713436 0.90 AKT1 (0.42) OPRK1SMPD3DYRK3PIM3SRPK1
SCHEMBL714766 0.87 PIK3CD (0.43) OPRK1SMPD3AKT1KRASSOS1
SCHEMBL714765 0.87 PIK3CD (0.43) OPRK1SMPD3AKT1KRASSOS1
SCHEMBL716736 0.85 OPRK1 (0.41) OPRK1
SCHEMBL716735 0.85 OPRK1 (0.41) OPRK1
SCHEMBL714750 0.85 DYRK3 (0.46) OPRK1SMPD3DYRK3PIM3SRPK1
SCHEMBL714751 0.85 DYRK3 (0.46) OPRK1SMPD3DYRK3PIM3SRPK1
SCHEMBL17530762 0.85 OPRK1 (0.40) OPRK1SMPD3DYRK3PIM3SRPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2403847-B1 TRIAZINE DERIVATIVES AS KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2016-03-02 EP claimed
US-8785628-B2 Triazine derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2014-07-22 US claimed
EP-2403847-B1 TRIAZINE DERIVATIVES AS KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2016-03-02 EP disclosed
US-8785628-B2 Triazine derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2014-07-22 US disclosed
US-20120053167-A1 Triazine Derivatives as Kinase Inhibitors UCB PHARMA, S.A. (BE) 2012-03-01 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-20120053167-A1 Triazine Derivatives as Kinase Inhibitors MAP3K15, PI4KA, MAP3K20 OPRK1 416/4885SMPD3 2503/4885DYRK3 419/4885

“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.