SCHEMBL9920262

SCHEMBL9920262

CC1CCCCC1Nc1c(C(=N)N)c(Cl)nn2ccnc12

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.38
ZAP70 P43403 2/20 0.38
JAK3 P52333 2/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
TAS1R3 Q7RTX0 12/20 0.35
TAS1R1 Q7RTX1 12/20 0.35
TAS1R2 Q8TE23 11/20 0.35
TSHR P16473 1/20 0.31
MEN1 O00255 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 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
SCHEMBL9920259 0.89 SYK (0.46) SYKZAP70JAK3JAK2JAK1
SCHEMBL9923406 0.86 ZAP70 (0.41) SYKZAP70JAK3JAK2JAK1
SCHEMBL9920260 0.81 JAK3 (0.41) SYKZAP70JAK3JAK2JAK1
SCHEMBL9920392 0.80 SYK (0.47) SYKZAP70JAK3JAK2JAK1
SCHEMBL9920254 0.79 SYK (0.46) SYKZAP70JAK3JAK2JAK1
SCHEMBL9923407 0.78 PIK3CG (0.34) SYKZAP70JAK3JAK2JAK1
SCHEMBL9920395 0.78 TAS1R3 (0.34) SYKZAP70JAK3JAK2JAK1
SCHEMBL9920391 0.76 TAS1R3 (0.34) SYKZAP70JAK3JAK2JAK1
SCHEMBL9920257 0.74 JAK3 (0.53) SYKZAP70JAK3JAK2JAK1
SCHEMBL9923291 0.70 JAK3 (0.42) SYKZAP70JAK3JAK2JAK1

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 SYK 85/4885ZAP70 20/4885JAK3 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.