SCHEMBL14670600

SCHEMBL14670600

Cc1cnc(Nc2cnn(CCO)c2)nc1NC(CO)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 15/20 0.51
▸ JAK2 O60674 13/20 0.51
▸ JAK1 P23458 13/20 0.51
▸ CDK19 Q9BWU1 2/20 0.43
▸ ALK Q9UM73 2/20 0.43
▸ MAP4K1 Q92918 2/20 0.43
▸ IRAK4 Q9NWZ3 2/20 0.43
▸ MAP4K3 Q8IVH8 1/20 0.43
▸ USP1 O94782 1/20 0.43
▸ WDR48 Q8TAF3 1/20 0.43
▸ TYK2 P29597 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
SCHEMBL15816846 0.88 JAK2 (0.51) JAK3JAK2JAK1IRAK4TYK2
SCHEMBL14670597 0.88 JAK2 (0.55) JAK3JAK2JAK1CDK19ALK
SCHEMBL15817882 0.88 JAK2 (0.55) JAK3JAK2JAK1CDK19ALK
SCHEMBL14670574 0.88 JAK2 (0.55) JAK3JAK2JAK1CDK19ALK
SCHEMBL14670599 0.88 JAK2 (0.51) JAK3JAK2JAK1IRAK4TYK2
SCHEMBL15817750 0.87 MAP4K1 (0.47) JAK3JAK2JAK1MAP4K1IRAK4
SCHEMBL14670533 0.87 MAP4K1 (0.47) JAK3JAK2JAK1MAP4K1IRAK4
SCHEMBL14663779 0.85 JAK3 (0.47) JAK3JAK2JAK1MAP4K1IRAK4
SCHEMBL14663777 0.85 JAK3 (0.47) JAK3JAK2JAK1MAP4K1IRAK4
SCHEMBL14663670 0.82 JAK2 (0.54) JAK3JAK2JAK1CDK19ALK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140179664-A1 Heterocyclyl Pyrimidine Analogues As JAK Inhibitors CELLZOME LIMITED (GB) 2014-06-26 — — US claimed
CN-103781780-A Heterocyclyl pyrimidine analogues as JAK inhibitors CELLZOME LTD 2014-05-07 — — CN claimed
US-20140179664-A1 Heterocyclyl Pyrimidine Analogues As JAK Inhibitors CELLZOME LIMITED (GB) 2014-06-26 — — US disclosed
US-20140179664-A1 Heterocyclyl Pyrimidine Analogues As JAK Inhibitors CELLZOME LIMITED (GB) 2014-06-26 — — US disclosed
US-20140179664-A1 Heterocyclyl Pyrimidine Analogues As JAK Inhibitors CELLZOME LIMITED (GB) 2014-06-26 — — US disclosed
CN-103781780-A Heterocyclyl pyrimidine analogues as JAK inhibitors CELLZOME LTD 2014-05-07 — — CN disclosed
WO-2013014162-A1 HETEROCYCLYL PYRIMIDINE ANALOGUES AS JAK INHIBITORS CELLZOME LIMITED (GB) 2013-01-31 — — 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 (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-20140179664-A1 Heterocyclyl Pyrimidine Analogues As JAK Inhibitors JAK1, JAK3, JAK2 JAK3 2/4885JAK2 3/4885JAK1 1/4885

“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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