SCHEMBL717459

SCHEMBL717459

Cc1nc(N)nc(NC(C)c2cc3ccc(F)c(C)c3nc2N2CCN(CC(F)(F)F)CC2)n1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 9/20 0.38
SOS1 Q07889 2/20 0.34
CYP2C8 P10632 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
PIK3CD O00329 3/20 0.31
SCN10A Q9Y5Y9 1/20 0.31
HRH4 Q9H3N8 3/20 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
SCHEMBL15875802 1.00 OPRK1 (0.38) OPRK1SOS1CYP2C8CYP2D6CYP2C9
SCHEMBL717163 0.87 HRH4 (0.41) OPRK1SOS1HRH4
SCHEMBL15875828 0.87 HRH4 (0.41) OPRK1SOS1HRH4
SCHEMBL713421 0.87 OPRK1 (0.40) OPRK1PIK3CDHRH4
SCHEMBL15875847 0.87 OPRK1 (0.40) OPRK1PIK3CDHRH4
SCHEMBL716484 0.83 MAPT (0.38) OPRK1SOS1HRH4
SCHEMBL716483 0.83 MAPT (0.38) OPRK1SOS1HRH4
SCHEMBL15875794 0.82 OPRK1 (0.40) OPRK1SCN10A
SCHEMBL714749 0.81 OPRK1 (0.39) OPRK1SCN10A
SCHEMBL716736 0.80 OPRK1 (0.41) OPRK1CYP2C9

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 2 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-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 416/4885SOS1 1414/4885CYP2C8 3240/4885

“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.