SCHEMBL2340144

SCHEMBL2340144

CC(C)NC(=O)Oc1cnc2[nH]cc(C(=O)C(C)(C)C)c2n1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 18/20 0.54
JAK2 O60674 15/20 0.54
JAK1 P23458 15/20 0.54
SYK P43405 2/20 0.44
CYP2C9 P11712 1/20 0.43

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
SCHEMBL2340923 0.83 JAK3 (0.49) JAK3JAK2JAK1
SCHEMBL2340082 0.82 JAK3 (0.43) JAK3JAK2JAK1
SCHEMBL2336424 0.82 JAK3 (0.48) JAK3JAK2JAK1
SCHEMBL650567 0.82 JAK3 (0.54) JAK3JAK2JAK1SYKCYP2C9
SCHEMBL2336488 0.81 JAK3 (0.47) JAK3JAK2JAK1
SCHEMBL2343623 0.81 JAK3 (0.48) JAK3JAK2JAK1SYK
SCHEMBL2341210 0.79 JAK3 (0.46) JAK3JAK2JAK1
SCHEMBL2339752 0.79 JAK3 (0.46) JAK3JAK2JAK1
SCHEMBL1633670 0.77 JAK3 (0.56) JAK3JAK2JAK1
SCHEMBL2341459 0.76 JAK3 (0.56) JAK3JAK2JAK1

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-2250172-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2011-08-31 EP claimed