SCHEMBL1002827

SCHEMBL1002827

CC(C)(C)OC(=O)NC1CCN(c2ccnc3[nH]ccc23)CC1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AKT2 P31751 3/20 0.58
JAK1 P23458 9/20 0.56
JAK2 O60674 5/20 0.56
JAK3 P52333 2/20 0.56
TYK2 P29597 1/20 0.56
PBK Q96KB5 2/20 0.52
CKS1B P61024 1/20 0.50
SKP1 P63208 1/20 0.50
SKP2 Q13309 1/20 0.50
GSK3B P49841 1/20 0.47
NUDT1 P36639 2/20 0.45
ATR Q13535 2/20 0.44
ATRIP Q8WXE1 2/20 0.44
DRD2 P14416 1/20 0.44

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
SCHEMBL24600565 0.85 CKS1B (0.48) AKT2JAK1JAK2JAK3TYK2
SCHEMBL29691572 0.85 CKS1B (0.48) AKT2JAK1JAK2JAK3TYK2
SCHEMBL30151464 0.85 KIT (0.60) AKT2JAK1JAK2JAK3TYK2
SCHEMBL1005506 0.85 KIT (0.60) AKT2JAK1JAK2JAK3TYK2
SCHEMBL15443939 0.84 JAK1 (0.54) JAK1JAK2JAK3TYK2PBK
SCHEMBL20647989 0.82 CKS1B (0.48) JAK1JAK2JAK3TYK2CKS1B
SCHEMBL15169781 0.81 JAK3 (0.57) JAK1JAK2JAK3
SCHEMBL10074324 0.81 JAK3 (0.57) JAK1JAK2JAK3
SCHEMBL20641158 0.81 MAP3K5 (0.58) JAK1JAK2JAK3CKS1BSKP1
SCHEMBL21173533 0.81 CKS1B (0.56) JAK1JAK2CKS1BSKP1SKP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3719018-B1 PURINE AND DEAZAPURINE DERIVATIVES AS PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LTD (GB) 2025-08-27 EP disclosed
US-20220169653-A1 PYRROLOPYRIMIDINE AND PYRROLOPYRIDINE DERIVATIVES GALAPAGOS NV (BE) 2022-06-02 US disclosed
US-20220169653-A1 PYRROLOPYRIMIDINE AND PYRROLOPYRIDINE DERIVATIVES GALAPAGOS NV (BE) 2022-06-02 US disclosed
US-11136325-B2 Pyrrolopyrimidine and pyrrolopyridine derivatives GALAPAGOS NV (BE) 2021-10-05 US disclosed
US-11136325-B2 Pyrrolopyrimidine and pyrrolopyridine derivatives GALAPAGOS NV (BE) 2021-10-05 US disclosed
EP-3421471-B1 PURINE AND DEAZAPURINE DERIVATIVES AS PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LTD (GB) 2021-05-26 EP disclosed
EP-3421471-B1 PURINE AND DEAZAPURINE DERIVATIVES AS PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LTD (GB) 2021-05-26 EP disclosed
EP-3719018-A1 PURINE AND DEAZAPURINE DERIVATIVES AS PHARMACEUTICAL COMPOUNDS Astex Therapeutics Ltd (GB) 2020-10-07 EP disclosed
EP-3719018-A1 PURINE AND DEAZAPURINE DERIVATIVES AS PHARMACEUTICAL COMPOUNDS Astex Therapeutics Ltd (GB) 2020-10-07 EP disclosed
US-20200165259-A1 PYRROLOPYRIMIDINE AND PYRROLOPYRIDINE DERIVATIVES GALAPAGOS NV (BE) 2020-05-28 US disclosed
US-8796293-B2 Purine and deazapurine derivatives as pharmaceutical compounds ASTEX THERAPEUTICS LIMITED (GB) 2014-08-05 US disclosed
US-20140107137-A1 Ortho-Condensed Pyridine and Pyrimidine Derivatives (e.g., Purines) as Protein Kinases Inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2014-04-17 US disclosed
US-20140107137-A1 Ortho-Condensed Pyridine and Pyrimidine Derivatives (e.g., Purines) as Protein Kinases Inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2014-04-17 US disclosed
US-8546407-B2 Ortho-condensed pyridine and pyrimidine derivatives (e.g., purines) as protein kinases inhibitors ASTEX THERAPEUTICS LIMITED (GB) 2013-10-01 US disclosed
US-8546407-B2 Ortho-condensed pyridine and pyrimidine derivatives (e.g., purines) as protein kinases inhibitors ASTEX THERAPEUTICS LIMITED (GB) 2013-10-01 US disclosed
EP-1812004-B1 ORTHO- CONDENSED PYRIDINE AND PYRIMIDINE DERIVATIVES (E. G. PURINES) AS PROTEIN KINASES INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2011-06-22 EP disclosed
EP-2272517-A1 Ortho-condensed pyridine and pyrimidine derivatives ( e.g. purines ) as protein kinases inhibitors Astex Therapeutics Limited (GB) 2011-01-12 EP disclosed
US-20100022564-A1 PURINE AND DEAZAPURINE DERIVATIVES AS PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2010-01-28 US disclosed
US-20090247538-A1 Ortho-Condensed Pyridine and Pyrimidine Derivatives (e.g., Purines) as Protein Kinases Inhibitors ASTEX THERAPEUTICS LIMITED (UK) 2009-10-01 US disclosed
WO-2007125321-A2 PURINE AND DEAZAPURINE DERIVATIVES AS PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2007-11-08 WO 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 (6 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-20200165259-A1 PYRROLOPYRIMIDINE AND PYRROLOPYRIDINE DERIVATIVES IRAK1, PEAK1, MARK1 AKT2 2675/4885JAK1 40/4885JAK2 211/4885
US-20140107137-A1 Ortho-Condensed Pyridine and Pyrimidine Derivatives (e.g., Purines) as Protein Kinases Inhibitors CDK1, CDK2, CDK3 AKT2 630/4885JAK1 372/4885JAK2 426/4885
US-20090247538-A1 Ortho-Condensed Pyridine and Pyrimidine Derivatives (e.g., Purines) as Protein Kinases Inhibitors CDK2, CDK1, OXSR1 AKT2 496/4885JAK1 357/4885JAK2 391/4885
US-11136325-B2 Pyrrolopyrimidine and pyrrolopyridine derivatives IRAK1, PEAK1, MARK1 AKT2 2675/4885JAK1 40/4885JAK2 211/4885
US-20220169653-A1 PYRROLOPYRIMIDINE AND PYRROLOPYRIDINE DERIVATIVES IRAK1, PEAK1, MARK1 AKT2 2675/4885JAK1 40/4885JAK2 211/4885
US-20100022564-A1 PURINE AND DEAZAPURINE DERIVATIVES AS PHARMACEUTICAL COMPOUNDS TPMT, CNKSR1, PRKD3 AKT2 126/4885JAK1 149/4885JAK2 252/4885

“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.