SCHEMBL2337576

SCHEMBL2337576

Cc1cnc(Nc2nc(N)nc(N3CCOCC3)c2[C@H](C)c2ncc(F)cn2)s1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 13/20 0.63
JAK3 P52333 10/20 0.59
KCNH2 Q12809 2/20 0.46
SYK P43405 1/20 0.38
PLK4 O00444 1/20 0.34
NUDT1 P36639 1/20 0.34
MAP2K7 O14733 1/20 0.34
PIK3CA P42336 1/20 0.34

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
SCHEMBL2336362 0.89 JAK2 (0.55) JAK2JAK3KCNH2SYKPLK4
SCHEMBL783936 0.80 JAK3 (0.61) JAK2JAK3PLK4
SCHEMBL2332810 0.79 KCNH2 (0.55) JAK2JAK3KCNH2
SCHEMBL2338571 0.78 JAK2 (0.46) JAK2JAK3KCNH2PIK3CA
SCHEMBL3008423 0.77 JAK2 (1.00) JAK2JAK3KCNH2
SCHEMBL251027 0.77 JAK2 (0.51) JAK2JAK3MAP2K7
SCHEMBL2161187 0.71 JAK2 (0.74) JAK2JAK3KCNH2
SCHEMBL4571027 0.71 JAK2 (0.74) JAK2JAK3KCNH2
SCHEMBL2339473 0.70 JAK2 (1.00) JAK2JAK3KCNH2
SCHEMBL589401 0.70 JAK3 (0.62) 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-2152702-B1 AMINO-THIAZOLYL- PYRIMIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2011-08-24 EP claimed
EP-2152702-B1 AMINO-THIAZOLYL- PYRIMIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2011-08-24 EP disclosed