SCHEMBL2054866

SCHEMBL2054866

CC(c1ccccc1)n1c(=O)[nH]c2cnc3[nH]ccc3c21

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 16/20 0.54
JAK3 P52333 16/20 0.54
JAK1 P23458 15/20 0.54
USP1 O94782 1/20 0.48
BRD4 O60885 3/20 0.47
BRD2 P25440 3/20 0.47
BRD3 Q15059 3/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 2/20 0.47

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
SCHEMBL2104055 1.00 JAK2 (0.54) JAK2JAK3JAK1USP1BRD4
SCHEMBL2104008 1.00 JAK2 (0.54) JAK2JAK3JAK1USP1BRD4
SCHEMBL2054859 0.84 JAK2 (0.50) JAK2JAK3JAK1USP1
SCHEMBL2054851 0.84 JAK2 (0.50) JAK2JAK3JAK1USP1
SCHEMBL2104052 0.84 JAK2 (0.57) JAK2JAK3JAK1
SCHEMBL2104682 0.84 JAK2 (0.57) JAK2JAK3JAK1
SCHEMBL2054849 0.83 JAK2 (0.49) JAK2JAK3JAK1USP1
SCHEMBL2054896 0.81 JAK2 (0.54) JAK2JAK3JAK1
SCHEMBL2106025 0.81 JAK2 (0.55) JAK2JAK3JAK1
SCHEMBL2054878 0.80 JAK2 (0.57) JAK2JAK3JAK1

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 JAK2 2/4885JAK3 1/4885JAK1 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.