SCHEMBL2055103

SCHEMBL2055103

C[C@@H]1CCCC[C@@H]1n1c(=O)n(CC(=O)c2ccc(S(C)(=O)=O)cc2)c2cnc3[nH]ccc3c21

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 20/20 0.49
JAK3 P52333 15/20 0.49
JAK2 O60674 15/20 0.49
TYK2 P29597 4/20 0.40

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
SCHEMBL2055083 0.88 JAK1 (0.48) JAK1JAK3JAK2TYK2
SCHEMBL2055123 0.86 JAK1 (0.52) JAK1JAK3JAK2TYK2
SCHEMBL2055082 0.85 JAK1 (0.48) JAK1JAK3JAK2TYK2
SCHEMBL2055127 0.84 JAK1 (0.49) JAK1JAK3JAK2TYK2
SCHEMBL2055104 0.83 JAK1 (0.48) JAK1JAK3JAK2TYK2
SCHEMBL2055186 0.82 JAK1 (0.51) JAK1JAK3JAK2TYK2
SCHEMBL2055120 0.81 JAK1 (0.47) JAK1JAK3JAK2TYK2
SCHEMBL2055184 0.79 JAK1 (0.46) JAK1JAK3JAK2TYK2
SCHEMBL2055115 0.78 JAK1 (0.47) JAK1JAK3JAK2TYK2
SCHEMBL2101922 0.78 JAK3 (0.62) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163767-B2 Heterocyclic Janus Kinase 3 inhibitors ASTELLAS PHARMA INC. (JP) 2012-04-24 US disclosed
US-8163767-B2 Heterocyclic Janus Kinase 3 inhibitors ASTELLAS PHARMA INC. (JP) 2012-04-24 US disclosed
US-20090264399-A1 HETEROCYCLIC JANUS KINASE 3 INHIBITORS ASTELLAS PHARMA INC. (JP) 2009-10-22 US disclosed
US-20090264399-A1 HETEROCYCLIC JANUS KINASE 3 INHIBITORS ASTELLAS PHARMA INC. (JP) 2009-10-22 US disclosed
WO-2007007919-A2 HETEROCYCLIC JANUS KINASE 3 INHIBITORS ASTELLAS PHARMA INC. (JP) 2007-01-18 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-20090264399-A1 HETEROCYCLIC JANUS KINASE 3 INHIBITORS JAK3, JAK2, JAK1 JAK1 3/4885JAK3 1/4885JAK2 2/4885

“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.