SCHEMBL12876022

SCHEMBL12876022

O=C(COc1ccccc1)c1cnc2[nH]ccc2c1N[C@@H]1C2C[C@@]3(O)CC2C[C@@H]1C3

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 20/20 0.56
▸ JAK2 O60674 14/20 0.56
▸ JAK3 P52333 14/20 0.56
▸ TYK2 P29597 8/20 0.56

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
SCHEMBL12888241 0.90 JAK1 (0.69) JAK1JAK2JAK3TYK2
SCHEMBL24723930 0.82 JAK2 (0.80) JAK1JAK2JAK3TYK2
SCHEMBL12876286 0.82 JAK1 (0.57) JAK1JAK2JAK3TYK2
SCHEMBL12876107 0.81 JAK3 (0.60) JAK1JAK2JAK3TYK2
SCHEMBL12876325 0.81 JAK1 (0.62) JAK1JAK2JAK3TYK2
SCHEMBL12876098 0.80 JAK1 (0.66) JAK1JAK2JAK3TYK2
SCHEMBL12888246 0.80 JAK1 (0.66) JAK1JAK2JAK3TYK2
SCHEMBL12876038 0.79 JAK2 (0.65) JAK1JAK2JAK3TYK2
SCHEMBL12888237 0.79 JAK1 (0.73) JAK1JAK2JAK3TYK2
SCHEMBL4439779 0.76 JAK1 (0.78) JAK1JAK2JAK3TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110039822-A1 HETEROCYCLIC JANUS KINASE 3 INHIBITORS ASTELLAS PHARMA INC. (JP) 2011-02-17 — — 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-20110039822-A1 HETEROCYCLIC JANUS KINASE 3 INHIBITORS JAK3, JAK1, JAK2 JAK1 2/4885JAK2 3/4885JAK3 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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