SCHEMBL8219903

SCHEMBL8219903

CS(=O)(=O)N(c1ncccc1-c1cnc2[nH]cc(C#N)c2n1)[C@H]1CCCNC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 5/20 0.53
JAK3 P52333 4/20 0.53
PCSK9 Q8NBP7 9/20 0.37
RPLP1 P05386 3/20 0.36
RPLP0 P05388 3/20 0.36
RPS17 P08708 3/20 0.36
RPSA P08865 3/20 0.36
RPS2 P15880 3/20 0.36
RPL35A P18077 3/20 0.36
RPL7 P18124 3/20 0.36
RPL17 P18621 3/20 0.36
RPS4Y1 P22090 3/20 0.36
RPS3 P23396 3/20 0.36
RPS12 P25398 3/20 0.36
RPL13 P26373 3/20 0.36
RPL10 P27635 3/20 0.36
RPL12 P30050 3/20 0.36
RPL9; RPL9P7; RPL9P8; RPL9P9 P32969 3/20 0.36
RPL22 P35268 3/20 0.36
RPL4 P36578 3/20 0.36

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
SCHEMBL8220391 0.85 JAK2 (0.56) JAK2JAK3CCNT1CCNKCCNE1
SCHEMBL8220389 0.85 JAK2 (0.56) JAK2JAK3CCNT1CCNKCCNE1
SCHEMBL8219671 0.73 JAK2 (0.53) JAK2JAK3
SCHEMBL8219667 0.73 JAK2 (0.53) JAK2JAK3
SCHEMBL8224445 0.70 ALOX5AP (0.43) JAK2JAK3
SCHEMBL8224443 0.70 ALOX5AP (0.43) JAK2JAK3
SCHEMBL6524824 0.69 JAK2 (1.00) JAK2JAK3
SCHEMBL6524827 0.69 JAK2 (1.00) JAK2JAK3
SCHEMBL12849205 0.68 JAK2 (0.68) JAK2JAK3CCNT1CCNKCCNE1
SCHEMBL8219827 0.67 JAK2 (0.58) JAK2JAK3

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
EP-2475667-A1 INHIBITORS OF JAK F. Hoffmann-La Roche AG (CH) 2012-07-18 EP disclosed
WO-2011029804-A1 INHIBITORS OF JAK F. HOFFMANN-LA ROCHE AG (CH) 2011-03-17 WO disclosed