SCHEMBL22349570

SCHEMBL22349570

CNS(=O)(=O)C1CCC(N(C)c2ncnc3[nH]ncc23)CC1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 18/20 0.52
▸ JAK2 O60674 13/20 0.52
▸ TYK2 P29597 7/20 0.52
▸ JAK3 P52333 12/20 0.51
▸ CHEK1 O14757 1/20 0.50
▸ AURKA O14965 1/20 0.50
▸ BTK Q06187 1/20 0.45

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
SCHEMBL21904665 0.85 CHEK1 (0.47) JAK1JAK2TYK2JAK3CHEK1
SCHEMBL18538828 0.83 JAK1 (0.70) JAK1JAK2TYK2JAK3
SCHEMBL22001611 0.82 JAK1 (0.74) JAK1JAK2TYK2JAK3
SCHEMBL14347072 0.80 JAK3 (0.63) JAK1JAK2JAK3CHEK1AURKA
SCHEMBL22349448 0.78 JAK1 (0.50) JAK1JAK2TYK2JAK3
SCHEMBL17545975 0.74 CHEK1 (0.56) JAK1JAK2JAK3CHEK1AURKA
SCHEMBL17545980 0.74 CHEK1 (0.56) JAK1JAK2JAK3CHEK1AURKA
SCHEMBL22001934 0.73 JAK1 (0.84) JAK1JAK2TYK2JAK3
SCHEMBL17545876 0.72 CHEK1 (0.54) JAK1JAK2JAK3CHEK1AURKA
SCHEMBL17545887 0.72 CHEK1 (0.54) JAK1JAK2JAK3CHEK1AURKA

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-10744136-B2 Sulfonamide derivatives as JAK inhibitors AVISTA PHARMA SOLUTIONS, INC. (US) 2020-08-18 — — 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-10744136-B2 Sulfonamide derivatives as JAK inhibitors JAK1, JAK3, JAK2 JAK1 1/4885JAK2 3/4885TYK2 26/4885

“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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