SCHEMBL9920399

SCHEMBL9920399

CC1CCCCC1Nc1c(OC=O)cnn2cnnc12

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
JAK3 P52333 1/20 0.32
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL9920390 0.83 ZAP70 (0.35) JAK2JAK1JAK3MEN1MAPT
SCHEMBL9920373 0.81 JAK2 (0.33) JAK2JAK1JAK3TSHR
SCHEMBL9920431 0.80 TSHR (0.33) JAK2JAK1JAK3MEN1MAPT
SCHEMBL9920421 0.79 JAK2 (0.35) JAK2JAK1JAK3MEN1MAPT
SCHEMBL9920359 0.78 JAK2 (0.43) JAK2JAK1JAK3TSHR
SCHEMBL9920411 0.78 JAK3 (0.35) JAK2JAK1JAK3MEN1MAPT
SCHEMBL9923341 0.78 JAK3 (0.40) JAK2JAK1JAK3MEN1MAPT
SCHEMBL9920412 0.77 TSHR (0.33) JAK2JAK1JAK3MEN1MAPT
SCHEMBL9920258 0.77 JAK3 (0.51) JAK2JAK1JAK3MEN1MAPT
SCHEMBL9923345 0.76 PKM (0.36) JAK2JAK1JAK3MEN1MAPT

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-20120149691-A1 Pyrrolo [1,2-b] Pyridazine Derivatives as Janus Kinase Inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2012-06-14 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-20120149691-A1 Pyrrolo [1,2-b] Pyridazine Derivatives as Janus Kinase Inhibitors JAK1, JAK2, JAK3 JAK2 2/4885JAK1 1/4885JAK3 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.