SCHEMBL18084491

SCHEMBL18084491

N#C[C@H]1CCOCC1n1nc(N)c2c(OCc3ccccc3)nccc21

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 19/20 0.46
JAK1 P23458 19/20 0.46
TYK2 P29597 1/20 0.38
JAK3 P52333 1/20 0.38
ATP4A P20648 1/20 0.37
ATP4B P51164 1/20 0.37

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
SCHEMBL16102315 1.00 JAK2 (0.46) JAK2JAK1TYK2JAK3ATP4A
SCHEMBL16103072 1.00 JAK2 (0.46) JAK2JAK1TYK2JAK3ATP4A
SCHEMBL18084498 1.00 JAK2 (0.46) JAK2JAK1TYK2JAK3ATP4A
SCHEMBL16121007 1.00 JAK2 (0.46) JAK2JAK1TYK2JAK3ATP4A
SCHEMBL16121008 0.95 JAK2 (0.41) JAK2JAK1TYK2JAK3ATP4A
SCHEMBL16121108 0.95 JAK2 (0.41) JAK2JAK1TYK2JAK3ATP4A
SCHEMBL16103414 0.95 JAK2 (0.41) JAK2JAK1TYK2JAK3ATP4A
SCHEMBL16103083 0.95 JAK2 (0.41) JAK2JAK1TYK2JAK3ATP4A
SCHEMBL16102111 0.95 JAK2 (0.41) JAK2JAK1TYK2JAK3ATP4A
SCHEMBL16102999 0.95 JAK2 (0.41) JAK2JAK1TYK2JAK3ATP4A

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-9957265-B2 N-(2-cyano heterocyclyl) pyrazolo pyridones as janus kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2018-05-01 US disclosed
US-20160272633-A1 N-(2-CYANO HETEROCYCLYL) PYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-09-22 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-20160272633-A1 N-(2-CYANO HETEROCYCLYL) PYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS JAK1, JAK2, JAK3 JAK2 2/4885JAK1 1/4885TYK2 4/4885

“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.