SCHEMBL7963258

SCHEMBL7963258

NCc1ccccc1NCc1ccc(-c2cccc3nc(NC(=O)C4CC4)nn23)cc1

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 6/20 0.80
JAK2 O60674 16/20 0.74
JAK3 P52333 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
SCHEMBL2238479 0.89 JAK1 (1.00) JAK1JAK2JAK3
SCHEMBL2238525 0.88 JAK2 (0.75) JAK1JAK2JAK3
SCHEMBL2239200 0.87 JAK2 (0.79) JAK1JAK2JAK3
SCHEMBL7964639 0.87 JAK2 (0.85) JAK1JAK2JAK3
SCHEMBL2238480 0.87 JAK2 (0.80) JAK1JAK2JAK3
SCHEMBL2238774 0.85 JAK2 (1.00) JAK1JAK2JAK3
SCHEMBL2241461 0.84 JAK2 (0.80) JAK1JAK2JAK3
SCHEMBL2244635 0.83 JAK3 (1.00) JAK1JAK2JAK3
SCHEMBL2238957 0.83 JAK2 (1.00) JAK1JAK2JAK3
SCHEMBL2237170 0.82 JAK2 (0.79) JAK1JAK2JAK3

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
WO-2010010190-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2010-01-28 WO disclosed