SCHEMBL10323187

SCHEMBL10323187

Clc1ccc(CNc2nccc(-c3n[nH]c4nc(NCCN5CCOCC5)ncc34)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EIF2AK2 P19525 3/20 0.53
▸ CXCR4 P61073 1/20 0.51
▸ MKNK1 Q9BUB5 3/20 0.51
▸ DYRK1A Q13627 2/20 0.49
▸ DYRK1B Q9Y463 2/20 0.49
▸ FLT3 P36888 3/20 0.48
▸ BACE1 P56817 1/20 0.48
▸ LMNA P02545 2/20 0.47
▸ TSHR P16473 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ CDK4 P11802 1/20 0.42
▸ GSK3B P49841 1/20 0.42

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
SCHEMBL10323641 0.91 FLT3 (0.58) EIF2AK2CXCR4MKNK1DYRK1ADYRK1B
SCHEMBL10322579 0.90 FLT3 (0.61) EIF2AK2CXCR4MKNK1DYRK1ADYRK1B
SCHEMBL10323703 0.89 CCNT1 (0.49) EIF2AK2CXCR4DYRK1ADYRK1BFLT3
SCHEMBL10323345 0.87 FLT3 (0.59) EIF2AK2CXCR4MKNK1DYRK1ADYRK1B
SCHEMBL10324576 0.86 MKNK1 (0.49) EIF2AK2CXCR4MKNK1DYRK1ADYRK1B
SCHEMBL10322219 0.84 LMNA (0.47) EIF2AK2CXCR4FLT3BACE1LMNA
SCHEMBL10322500 0.82 MKNK1 (0.50) EIF2AK2CXCR4MKNK1DYRK1ADYRK1B
SCHEMBL10322415 0.82 FLT3 (0.51) EIF2AK2MKNK1DYRK1ADYRK1BFLT3
SCHEMBL10321912 0.81 MKNK1 (0.49) EIF2AK2MKNK1DYRK1ADYRK1BFLT3
SCHEMBL10321917 0.81 DYRK1A (0.64) EIF2AK2CXCR4MKNK1DYRK1ADYRK1B

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 EIF2AK2 1860/4885CXCR4 1691/4885MKNK1 606/4885

“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.

Send feedback