SCHEMBL10323825

SCHEMBL10323825

COC(=O)c1ccc(C)c(NC(=O)c2cc3cnc(N4CCOCC4)nc3[nH]c2=O)c1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 11/20 0.68
▸ DYRK1B Q9Y463 9/20 0.68
▸ BRAF P15056 5/20 0.45
▸ LMNA P02545 1/20 0.44
▸ PIK3CA P42336 1/20 0.43
▸ MTOR P42345 1/20 0.43
▸ PIK3CG P48736 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL11949573 0.92 DYRK1A (0.56) DYRK1ADYRK1BBRAFPIK3CAMTOR
SCHEMBL10323628 0.91 DYRK1A (0.68) DYRK1ADYRK1B
SCHEMBL10323700 0.82 ALDH1A1 (0.43) DYRK1ADYRK1BPIK3CAMTORPIK3CG
SCHEMBL10323339 0.82 DYRK1A (0.70) DYRK1ADYRK1B
SCHEMBL10323269 0.81 DYRK1A (0.69) DYRK1ADYRK1B
SCHEMBL10323050 0.81 DYRK1A (0.69) DYRK1ADYRK1B
SCHEMBL10324364 0.81 DYRK1A (1.00) DYRK1ADYRK1B
SCHEMBL10323777 0.79 DYRK1A (0.76) DYRK1ADYRK1BKMT2A
SCHEMBL10323894 0.79 DYRK1A (0.75) DYRK1ADYRK1B
SCHEMBL10447106 0.78 DYRK1A (0.54) DYRK1ADYRK1B

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
WO-2012098065-A1 PYRIDO PYRIMIDINES FOR USE AS DYRK1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — WO claimed
US-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 — — US claimed
WO-2012098065-A1 PYRIDO PYRIMIDINES FOR USE AS DYRK1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — WO disclosed
US-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 — — US disclosed
US-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 — — US disclosed
US-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 — — 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-20120184542-A1 PYRIDO PYRIMIDINES TYMS, TYMP, DPYD DYRK1A 654/4885DYRK1B 570/4885BRAF 1576/4885

“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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