SCHEMBL7964201

SCHEMBL7964201

C=C(CN1CCOCC1)NC(=O)c1ccc(-c2cccc3nc(NC(=O)C4CC4)nn23)cc1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 16/20 0.72
▸ JAK2 O60674 11/20 0.71
▸ JAK3 P52333 3/20 0.71
▸ TYK2 P29597 1/20 0.71

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
SCHEMBL2241118 0.84 JAK1 (1.00) JAK1JAK2JAK3TYK2
SCHEMBL2238639 0.83 JAK1 (1.00) JAK1JAK2JAK3TYK2
SCHEMBL217727 0.83 JAK2 (1.00) JAK1JAK2JAK3TYK2
SCHEMBL2237921 0.82 JAK2 (1.00) JAK1JAK2JAK3TYK2
SCHEMBL216776 0.81 JAK1 (1.00) JAK1JAK2JAK3TYK2
SCHEMBL2237498 0.79 JAK1 (1.00) JAK1JAK2JAK3TYK2
SCHEMBL13031528 0.78 JAK1 (0.69) JAK1JAK2JAK3TYK2
SCHEMBL219962 0.78 JAK1 (1.00) JAK1JAK2JAK3TYK2
SCHEMBL2240406 0.78 JAK1 (1.00) JAK1JAK2JAK3
SCHEMBL7960602 0.78 JAK2 (1.00) JAK1JAK2JAK3TYK2

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-20110190260-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES ALFASIGMA S.P.A. (IT) 2011-08-04 — — US disclosed
WO-2010010190-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2010-01-28 — — WO 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-20110190260-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES TRAF6, IL6, TLR6 JAK1 84/4885JAK2 174/4885JAK3 209/4885

“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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