SCHEMBL10324008

SCHEMBL10324008

O=C(O)c1cc2cnc(NCCN3CCCC3)nc2[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 2/20 0.47
▸ DYRK1B Q9Y463 1/20 0.47
▸ CCNA2 P20248 2/20 0.41
▸ CDK2 P24941 2/20 0.41
▸ CCNA1 P78396 2/20 0.41
▸ ATM Q13315 1/20 0.37
▸ BRAF P15056 1/20 0.36
▸ CSNK2A1 P68400 2/20 0.36
▸ TERT O14746 1/20 0.36
▸ CSF1R P07333 1/20 0.36
▸ GRIN1 Q05586 1/20 0.36
▸ GRIN2B Q13224 1/20 0.36
▸ LCK P06239 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ PIM3 Q86V86 1/20 0.35
▸ BRSK1 Q8TDC3 1/20 0.35
▸ AURKB Q96GD4 1/20 0.35

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
SCHEMBL10323489 0.91 DYRK1A (0.55) DYRK1ADYRK1BCCNA2CDK2CCNA1
SCHEMBL10323036 0.85 DYRK1A (0.56) DYRK1ADYRK1BCSF1R
SCHEMBL10322727 0.84 MERTK (0.52) DYRK1ACSNK2A1LCKMAPK14
SCHEMBL17910151 0.76 MAPK8 (0.42) CCNA2CDK2CCNA1GRIN1GRIN2B
SCHEMBL10322984 0.74 ALDH1A1 (0.46) DYRK1ADYRK1BKDM4EHSD17B10
SCHEMBL10446965 0.72 DYRK1A (0.68) DYRK1ADYRK1B
SCHEMBL7694476 0.72 ALDH1A1 (0.45) GRIN1GRIN2BKDRKDM4EHSD17B10
SCHEMBL10324431 0.72 DYRK1A (0.39) DYRK1ADYRK1BKDM4E
SCHEMBL10324022 0.71 HSP90AA1 (0.42) CCNA2CDK2AURKBKDM4E
SCHEMBL10323705 0.70 DHODH (0.45) —

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
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
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 570/4885CCNA2 147/4885

“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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