SCHEMBL3311337

SCHEMBL3311337

CNC(=O)C(=O)Nc1nn([C@H]2CNCC[C@H]2C)c2c1cnc1[nH]ccc12

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 20/20 0.44
JAK1 P23458 17/20 0.44
JAK3 P52333 15/20 0.44
TYK2 P29597 6/20 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
SCHEMBL3311412 1.00 JAK2 (0.44) JAK2JAK1JAK3TYK2
SCHEMBL13398135 0.91 JAK2 (0.40) JAK2JAK1JAK3TYK2
SCHEMBL3313428 0.91 JAK2 (0.43) JAK2JAK1JAK3TYK2
SCHEMBL3313006 0.91 JAK2 (0.43) JAK2JAK1JAK3TYK2
SCHEMBL13398058 0.90 JAK2 (0.39) JAK2JAK1JAK3TYK2
SCHEMBL13398350 0.89 JAK2 (0.50) JAK2JAK1JAK3TYK2
SCHEMBL13398084 0.88 JAK1 (0.48) JAK2JAK1JAK3TYK2
SCHEMBL13398091 0.87 JAK2 (0.41) JAK2JAK1JAK3TYK2
Hydrochloric Acid SCHEMBL3314155 0.87 JAK1 (0.48) JAK2JAK1JAK3TYK2
SCHEMBL13398142 0.86 JAK2 (0.43) JAK2JAK1JAK3TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105661-A1 CONDENSED PYRIDINE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-04-29 US disclosed
US-20100105661-A1 CONDENSED PYRIDINE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-04-29 US disclosed
US-20100105661-A1 CONDENSED PYRIDINE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-04-29 US disclosed
EP-2123651-A1 CONDENSED PYRIDINE COMPOUND Astellas Pharma Inc. (JP) 2009-11-25 EP 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-20100105661-A1 CONDENSED PYRIDINE COMPOUND JAK3, IRAK3, JAK1 JAK2 5/4885JAK1 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.