SCHEMBL13059404

SCHEMBL13059404

CN1CCN(c2cccc(Nc3nc4c(-c5ccccc5N(C)S(C)(=O)=O)cccn4n3)c2)CC1

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 20/20 0.79
▸ PTK2 Q05397 20/20 0.79
▸ JAK3 P52333 19/20 0.79
▸ ABCB1 P08183 1/20 0.70
▸ CYP3A4 P08684 1/20 0.70
▸ JAK1 P23458 1/20 0.70

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
SCHEMBL13058850 0.91 JAK2 (0.80) JAK2PTK2JAK3JAK1
SCHEMBL2634718 0.88 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4
SCHEMBL2634615 0.88 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4
SCHEMBL2640506 0.88 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4
SCHEMBL2635441 0.86 JAK2 (1.00) JAK2PTK2JAK3
SCHEMBL2634771 0.86 PTK2 (1.00) JAK2PTK2JAK3CYP3A4JAK1
SCHEMBL13059787 0.84 JAK2 (0.77) JAK2PTK2JAK3
SCHEMBL2635135 0.83 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4
SCHEMBL30925315 0.82 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4
SCHEMBL2634485 0.82 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4

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-20100311693-A1 Preparation and Uses of 1,2,4-Triazolo [1,5a] Pyridine Derivatives CEPHALON, INC. (US) 2010-12-09 — — 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-20100311693-A1 Preparation and Uses of 1,2,4-Triazolo [1,5a] Pyridine Derivatives CCNA1, CCNY, RB1 JAK2 31/4885PTK2 1114/4885JAK3 175/4885

“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.

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