SCHEMBL15654134

SCHEMBL15654134

O=C(Nc1nc2cccc(-c3ccc(C(C(=O)N4CCCCCC4)c4ccc(C(=O)N5CCCCCC5)cc4)cc3)n2n1)C1CC1

nearest known ligand 0.84

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 17/20 0.84
TYK2 P29597 2/20 0.84
JAK1 P23458 11/20 0.73
JAK3 P52333 3/20 0.68

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
SCHEMBL2243221 0.92 JAK2 (1.00) JAK2TYK2JAK1JAK3
SCHEMBL2238494 0.91 JAK2 (1.00) JAK2TYK2JAK1JAK3
SCHEMBL2238445 0.84 JAK1 (1.00) JAK2TYK2JAK1JAK3
SCHEMBL2241762 0.84 JAK2 (1.00) JAK2TYK2JAK1JAK3
SCHEMBL2238034 0.84 JAK2 (0.85) JAK2TYK2JAK1JAK3
SCHEMBL2237211 0.83 JAK1 (1.00) JAK2TYK2JAK1JAK3
SCHEMBL2237921 0.83 JAK2 (1.00) JAK2TYK2JAK1JAK3
SCHEMBL2760293 0.83 JAK2 (0.83) JAK2TYK2JAK1JAK3
SCHEMBL2237152 0.83 JAK2 (1.00) JAK2TYK2JAK1JAK3
SCHEMBL2238754 0.83 JAK2 (1.00) JAK2TYK2JAK1JAK3

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
EP-2361251-B1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2014-04-30 EP claimed