SCHEMBL716953

SCHEMBL716953

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

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 12/20 0.44
DYRK3 O43781 1/20 0.43
PIM3 Q86V86 1/20 0.43
SRPK1 Q96SB4 1/20 0.43
CSNK1G1 Q9HCP0 1/20 0.43
AKT1 P31749 1/20 0.43
SMPD3 Q9NY59 5/20 0.42
ACACB O00763 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OGFRL1 Q5TC84 1/20 0.40

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
SCHEMBL716954 1.00 OPRK1 (0.44) OPRK1DYRK3PIM3SRPK1CSNK1G1
SCHEMBL714751 0.89 DYRK3 (0.46) OPRK1DYRK3PIM3SRPK1CSNK1G1
SCHEMBL714750 0.89 DYRK3 (0.46) OPRK1DYRK3PIM3SRPK1CSNK1G1
SCHEMBL716284 0.85 OPRK1 (0.41) OPRK1DYRK3PIM3SRPK1CSNK1G1
SCHEMBL716285 0.85 OPRK1 (0.41) OPRK1DYRK3PIM3SRPK1CSNK1G1
SCHEMBL713435 0.84 AKT1 (0.42) OPRK1DYRK3PIM3SRPK1CSNK1G1
SCHEMBL713436 0.84 AKT1 (0.42) OPRK1DYRK3PIM3SRPK1CSNK1G1
SCHEMBL2113711 0.79 OPRK1 (0.38) OPRK1
SCHEMBL2113713 0.79 OPRK1 (0.38) OPRK1
SCHEMBL2117490 0.77 OPRK1 (0.38) OPRK1

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 3 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 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 416/4885DYRK3 419/4885PIM3 591/4885

“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.