SCHEMBL566462

SCHEMBL566462

CC(C)(C)[Si](C)(C)O[C@]12CC3C[C@H](C1)[C@H](Nc1c(CO)cnc4c1ccn4COCC[Si](C)(C)C)[C@@H](C3)C2

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
JAK3 P52333 1/20 0.33

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
SCHEMBL566463 1.00 JAK2 (0.33) JAK2JAK1JAK3
SCHEMBL566918 0.88 JAK2 (0.33) JAK2JAK1JAK3
SCHEMBL566917 0.88 JAK2 (0.33) JAK2JAK1JAK3
SCHEMBL566985 0.86 JAK2 (0.32) JAK2JAK1JAK3
SCHEMBL566987 0.86 JAK2 (0.32) JAK2JAK1JAK3
SCHEMBL566986 0.86 JAK2 (0.32) JAK2JAK1JAK3
SCHEMBL566871 0.86 JAK1 (0.38) JAK2JAK1JAK3
SCHEMBL566872 0.86 JAK1 (0.38) JAK2JAK1JAK3
SCHEMBL10099307 0.85 KLKB1 (0.32) JAK2JAK1JAK3
SCHEMBL631229 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2420502-A1 FUSED PYRROLOPYRIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2012-02-22 EP disclosed
US-20120034250-A1 CONDENSED PYRROLOPYRIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-02-09 US disclosed
US-20120034250-A1 CONDENSED PYRROLOPYRIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-02-09 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-20120034250-A1 CONDENSED PYRROLOPYRIDINE DERIVATIVE JAK2, JAK1, JAK3 JAK2 1/4885JAK1 2/4885JAK3 3/4885

“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.