SCHEMBL2339836

SCHEMBL2339836

CC(C)(C)C(=O)c1c[nH]c2ncc(NCCC3CCCC3)nc12

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 19/20 0.47
SYK P43405 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
SCHEMBL2336367 0.90 JAK3 (0.55) JAK3SYK
SCHEMBL12450079 0.81 JAK3 (0.43) JAK3
SCHEMBL2343358 0.80 JAK3 (0.48) JAK3SYK
SCHEMBL2341558 0.77 JAK3 (0.55) JAK3
SCHEMBL2336764 0.77 JAK3 (0.55) JAK3
SCHEMBL2340467 0.76 JAK3 (0.48) JAK3
SCHEMBL2342183 0.74 JAK3 (0.57) JAK3
SCHEMBL1633670 0.74 JAK3 (0.56) JAK3
SCHEMBL1890379 0.74 JAK3 (0.67) JAK3
SCHEMBL1369300 0.74 JAK3 (0.75) JAK3SYK

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