SCHEMBL9920231

SCHEMBL9920231

CN1CCC(Oc2ccc(Nc3c(C(N)=O)cnn4cccc34)cc2Cl)CC1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 18/20 0.48
JAK1 P23458 18/20 0.48
TYK2 P29597 18/20 0.48
JAK3 P52333 18/20 0.48
ROCK2 O75116 1/20 0.44
EGFR P00533 1/20 0.43
ERBB2 P04626 1/20 0.43

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
SCHEMBL9920235 0.84 CSF1R (0.52) JAK2JAK1TYK2JAK3
SCHEMBL9923039 0.78 JAK3 (0.47) JAK2JAK1TYK2JAK3
SCHEMBL9920229 0.78 JAK3 (0.45) JAK2JAK1TYK2JAK3
SCHEMBL9920209 0.77 JAK3 (0.44) JAK2JAK1TYK2JAK3
SCHEMBL9918540 0.72 EGFR (0.42) JAK2JAK1JAK3ROCK2EGFR
SCHEMBL9920207 0.71 JAK3 (0.45) JAK2JAK1TYK2JAK3
SCHEMBL1160541 0.71 JAK1 (0.60) JAK2JAK1TYK2JAK3
SCHEMBL9920240 0.70 JAK2 (0.50) JAK2JAK1TYK2JAK3
SCHEMBL9923296 0.69 JAK2 (0.47) JAK2JAK1TYK2JAK3
SCHEMBL9920241 0.69 JAK2 (0.47) JAK2JAK1TYK2JAK3

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 2 patents. 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
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 1/4885TYK2 10/4885

“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.