SCHEMBL10322579

SCHEMBL10322579

Clc1cccc(CNc2nccc(-c3n[nH]c4nc(NCCN5CCOCC5)ncc34)n2)c1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 4/20 0.61
▸ EIF2AK2 P19525 3/20 0.53
▸ DYRK1A Q13627 2/20 0.49
▸ DYRK1B Q9Y463 2/20 0.49
▸ MKNK1 Q9BUB5 4/20 0.48
▸ LMNA P02545 1/20 0.46
▸ CXCR4 P61073 1/20 0.45
▸ CCNT1 O60563 1/20 0.43
▸ CDK4 P11802 1/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ ABL1 P00519 1/20 0.41
▸ BCR P11274 1/20 0.41

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
SCHEMBL10322415 0.93 FLT3 (0.51) FLT3EIF2AK2DYRK1ADYRK1BMKNK1
SCHEMBL10354002 0.92 FLT3 (0.51) FLT3EIF2AK2DYRK1ADYRK1BMKNK1
SCHEMBL10322178 0.91 CCNT1 (0.54) FLT3EIF2AK2DYRK1ADYRK1BLMNA
SCHEMBL10323194 0.91 FLT3 (0.50) FLT3EIF2AK2DYRK1ADYRK1BMKNK1
SCHEMBL10323187 0.90 EIF2AK2 (0.53) FLT3EIF2AK2DYRK1ADYRK1BMKNK1
SCHEMBL10323641 0.90 FLT3 (0.58) FLT3EIF2AK2DYRK1ADYRK1BMKNK1
SCHEMBL10321917 0.86 DYRK1A (0.64) FLT3EIF2AK2DYRK1ADYRK1BMKNK1
SCHEMBL10323345 0.86 FLT3 (0.59) FLT3EIF2AK2DYRK1ADYRK1BMKNK1
SCHEMBL10322542 0.84 FLT3 (0.44) FLT3EIF2AK2LMNACCNT1
SCHEMBL10322997 0.83 ADORA1 (0.45) FLT3EIF2AK2MKNK1CCNT1CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362023-B2 Pyrazolo pyrimidines HOFFMANN-LA ROCHE INC. (US) 2013-01-29 — — US claimed
WO-2012098068-A1 PYRAZOLO PYRIMIDINES AS DYRK1A AND DYRK1B INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — WO claimed
US-20120184508-A1 PYRAZOLO PYRIMIDINES BIODURO (BEIJING) COMPANY LTD. (CN) 2012-07-19 — — US claimed
US-8362023-B2 Pyrazolo pyrimidines HOFFMANN-LA ROCHE INC. (US) 2013-01-29 — — US disclosed
US-8362023-B2 Pyrazolo pyrimidines HOFFMANN-LA ROCHE INC. (US) 2013-01-29 — — US disclosed
WO-2012098068-A1 PYRAZOLO PYRIMIDINES AS DYRK1A AND DYRK1B INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — WO disclosed
WO-2012098068-A1 PYRAZOLO PYRIMIDINES AS DYRK1A AND DYRK1B INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — WO disclosed
US-20120184508-A1 PYRAZOLO PYRIMIDINES BIODURO (BEIJING) COMPANY LTD. (CN) 2012-07-19 — — US disclosed
US-20120184508-A1 PYRAZOLO PYRIMIDINES BIODURO (BEIJING) COMPANY LTD. (CN) 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-20120184508-A1 PYRAZOLO PYRIMIDINES TYMS, TYMP, TP53 FLT3 1618/4885EIF2AK2 1860/4885DYRK1A 1060/4885

“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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