SCHEMBL8328800

SCHEMBL8328800

Nc1[nH]nc2ncncc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.52
DYRK1B Q9Y463 2/20 0.52
RET P07949 2/20 0.52
LRRK2 Q5S007 2/20 0.52
CDK9 P50750 2/20 0.52
CDK5 Q00535 2/20 0.52
CHEK1 O14757 1/20 0.52
AURKA O14965 1/20 0.52
DAPK3 O43293 1/20 0.52
JAK2 O60674 1/20 0.52
MAP4K4 O95819 1/20 0.52
PAK4 O96013 1/20 0.52
ABL1 P00519 1/20 0.52
CSF1R P07333 1/20 0.52
IGF1R P08069 1/20 0.52
FGFR1 P11362 1/20 0.52
PDGFRA P16234 1/20 0.52
PRKACA P17612 1/20 0.52
FLT1 P17948 1/20 0.52
LTK P29376 1/20 0.52

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
SCHEMBL8319708 0.78 DYRK1B (0.40) DYRK1ADYRK1BRETLRRK2CDK9
SCHEMBL21806796 0.75 DYRK1A (0.38) DYRK1ADYRK1BRETLRRK2CDK9
SCHEMBL15726869 0.75 PIM1 (0.45) DYRK1ADYRK1BRETLRRK2CDK9
SCHEMBL23199596 0.75 DYRK1B (0.45) DYRK1ADYRK1BRETLRRK2CDK9
SCHEMBL8327596 0.75 DYRK1A (0.38) DYRK1ADYRK1BRETLRRK2CDK9
SCHEMBL1689336 0.72 CCNA2 (0.42) DYRK1ADYRK1BRETLRRK2CDK9
SCHEMBL4697303 0.71 GAA (0.48) DYRK1ADYRK1BRETLRRK2CDK9
SCHEMBL20142243 0.71 DYRK1A (0.35) DYRK1ADYRK1B
SCHEMBL15723268 0.71 DYRK1A (0.35) DYRK1ADYRK1BCDK1CCNB1HSP90AA1
SCHEMBL4779596 0.71 DYRK1A (0.38) DYRK1ADYRK1BCDK5CHEK1AURKA

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0353941-A2 Medicament for psoriasis containing derivatives of 3-aminopyrazolo [3,4-d]pyrimidine Takeda Chemical Industries, Ltd. (JP) 1990-02-07 EP claimed
JP-2138217-A None JP disclosed
US-20220064167-A1 IMIDAZO-PYRAZOLE CARBOXAMIDE DERIVATIVES AS ANTICANCER AGENTS AND THE SYNTHESIS THEREOF AVIDIN KFT. (HU) 2022-03-03 US disclosed
EP-3883649-A1 IMIDAZO-PYRAZOLE CARBOXAMIDE DERIVATIVES AS ANTICANCER AGENTS AND THE SYNTHESIS THEREOF Avidin KFT (HU) 2021-09-29 EP disclosed
WO-2014149206-A1 PYRAZOLOPYRIMIDINE-BASED INSECTICIDAL COMPOSITIONS AND RELATED METHODS DOW AGROSCIENCES LLC (US) 2014-09-25 WO disclosed
EP-0496617-B1 Adenosine kinase inhibitors METABASIS THERAPEUTICS INC (US) 1999-12-01 EP disclosed
EP-0682519-A4 ADENOSINE KINASE INHIBITORS. GENSIA INC (US) 1997-12-17 EP disclosed
US-5646128-A TREATING INFLAMMATION, SEPSIS, SEPTIC SHOCK, BURNS GENSIA, INC. (US) 1997-07-08 US disclosed
EP-0682519-A1 ADENOSINE KINASE INHIBITORS GENSIA, INC. (US) 1995-11-22 EP disclosed
EP-0383465-B1 Tricyclic fused pyrimidine derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-05-03 EP disclosed
EP-0353941-A2 Medicament for psoriasis containing derivatives of 3-aminopyrazolo [3,4-d]pyrimidine Takeda Chemical Industries, Ltd. (JP) 1990-02-07 EP disclosed
EP-0353941-A2 Medicament for psoriasis containing derivatives of 3-aminopyrazolo [3,4-d]pyrimidine Takeda Chemical Industries, Ltd. (JP) 1990-02-07 EP disclosed
EP-0166054-B1 3-AMINOPYRAZOLO(3,4-D)PYRIMIDINE DERIVATIVES AND PRODUCTION THEREOF Takeda Chemical Industries, Ltd. (JP) 1989-04-19 EP disclosed
US-4603203-A ANTIINFLAMMATORY, ANALGESIC AND ANTIPYRETIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-07-29 US disclosed
US-4603203-A ANTIINFLAMMATORY, ANALGESIC AND ANTIPYRETIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-07-29 US disclosed
US-4603203-A ANTIINFLAMMATORY, ANALGESIC AND ANTIPYRETIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-07-29 US disclosed
EP-0166054-A1 3-Aminopyrazolo(3,4-d)pyrimidine derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1986-01-02 EP disclosed
EP-0166054-A1 3-Aminopyrazolo(3,4-d)pyrimidine derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1986-01-02 EP disclosed
EP-0166054-A1 3-Aminopyrazolo(3,4-d)pyrimidine derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1986-01-02 EP disclosed
US-4292391-A PYRAZOLO/3,4-D/PYRIMIDINES; PHOTOLITHOGRAPHY E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-09-29 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-20220064167-A1 IMIDAZO-PYRAZOLE CARBOXAMIDE DERIVATIVES AS ANTICANCER AGENTS AND THE SYNTHESIS THEREOF MYD88, MCL1, MYADM DYRK1A 1419/4885DYRK1B 1801/4885RET 67/4885

“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.