SCHEMBL3359760

SCHEMBL3359760

Cc1cc(Nc2nc(O)cc3c2C(=O)[N]C=C3)ccc1N1CCO[C@H](C)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 1/20 0.48
SYK P43405 2/20 0.34
TNK2 Q07912 2/20 0.34
AKT1 P31749 1/20 0.34
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33
JAK3 P52333 1/20 0.33
KIF18A Q8NI77 2/20 0.33
P2RX3 P56373 1/20 0.33
NR3C2 P08235 1/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
PRKDC P78527 1/20 0.33
RAF1 P04049 2/20 0.32
BRAF P15056 2/20 0.32
MAPK9 P45984 1/20 0.32
MAPK10 P53779 1/20 0.32
EML4 Q9HC35 1/20 0.32
ALK Q9UM73 1/20 0.32

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
SCHEMBL3359423 0.86 ZAP70 (0.55) ZAP70SYKTNK2JAK2JAK1
SCHEMBL3359065 0.86 ZAP70 (0.55) ZAP70SYKTNK2JAK2JAK1
SCHEMBL3359539 0.86 ZAP70 (0.65) ZAP70SYKTNK2JAK2JAK1
SCHEMBL3360218 0.86 ZAP70 (0.48) ZAP70SYKTNK2AKT1JAK2
SCHEMBL3358663 0.85 ZAP70 (0.57) ZAP70SYKTNK2JAK2JAK1
SCHEMBL3360938 0.84 ZAP70 (0.49) ZAP70TNK2JAK2JAK1TYK2
SCHEMBL3362594 0.84 ZAP70 (0.55) ZAP70SYKTNK2JAK2JAK1
SCHEMBL3362713 0.83 ZAP70 (0.56) ZAP70SYKTNK2JAK2JAK1
SCHEMBL3361973 0.82 ZAP70 (0.47) ZAP70SYKTNK2JAK2JAK1
SCHEMBL3359176 0.82 ZAP70 (0.54) ZAP70SYKTNK2JAK2JAK1

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-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP claimed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO claimed