SCHEMBL12876304

SCHEMBL12876304

COC(=O)/C=C/c1cnc2[nH]ccc2c1N[C@H]1C2CC3CC1C[C@@](C)(C3)C2

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 18/20 0.57
JAK3 P52333 17/20 0.57
JAK2 O60674 14/20 0.57
TYK2 P29597 6/20 0.52

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
SCHEMBL1154170 0.91 JAK1 (0.65) JAK1JAK3JAK2TYK2
SCHEMBL4440771 0.80 JAK1 (0.68) JAK1JAK3JAK2TYK2
SCHEMBL4440769 0.80 JAK1 (0.68) JAK1JAK3JAK2TYK2
SCHEMBL4440765 0.80 JAK1 (0.68) JAK1JAK3JAK2TYK2
SCHEMBL12888138 0.75 JAK1 (0.64) JAK1JAK3JAK2TYK2
SCHEMBL12876848 0.75 JAK1 (0.68) JAK1JAK3JAK2TYK2
SCHEMBL12888915 0.74 JAK3 (0.62) JAK1JAK3JAK2TYK2
SCHEMBL1154788 0.74 JAK1 (0.71) JAK1JAK3JAK2TYK2
SCHEMBL1154946 0.74 JAK1 (0.71) JAK1JAK3JAK2TYK2
SCHEMBL1154172 0.74 JAK1 (0.67) JAK1JAK3JAK2TYK2

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 2/4885JAK3 1/4885JAK2 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.