SCHEMBL3359065

SCHEMBL3359065

Cc1cc(Nc2nc(-c3cncnc3)cc3c2C(=O)[N]C=C3)ccc1N1CCO[C@H](C)C1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 3/20 0.55
SYK P43405 4/20 0.36
LRRK2 Q5S007 1/20 0.34
TNK2 Q07912 4/20 0.33
SMO Q99835 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33
JAK3 P52333 1/20 0.33
MAPT P10636 5/20 0.31
GSK3A P49840 3/20 0.31
GSK3B P49841 3/20 0.31
PIM1 P11309 1/20 0.31
CDK2 P24941 1/20 0.31
CDK5 Q00535 1/20 0.31
PRKCQ Q04759 1/20 0.31
AAK1 Q2M2I8 1/20 0.31

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 1.00 ZAP70 (0.55) ZAP70SYKLRRK2TNK2SMO
SCHEMBL3359539 0.92 ZAP70 (0.65) ZAP70SYKTNK2SMOJAK2
SCHEMBL3358405 0.92 ZAP70 (0.46) ZAP70SYKLRRK2SMOJAK3
SCHEMBL3358663 0.90 ZAP70 (0.57) ZAP70SYKTNK2SMOJAK2
SCHEMBL3362713 0.90 ZAP70 (0.56) ZAP70SYKTNK2SMOJAK2
SCHEMBL3362594 0.89 ZAP70 (0.55) ZAP70SYKTNK2SMOJAK2
SCHEMBL3357730 0.88 ZAP70 (0.55) ZAP70SYKTNK2SMOJAK2
SCHEMBL3359939 0.88 ZAP70 (0.55) ZAP70SYKTNK2SMOJAK2
SCHEMBL3360938 0.88 ZAP70 (0.49) ZAP70TNK2SMOJAK2JAK1
SCHEMBL3359176 0.88 ZAP70 (0.54) ZAP70SYKTNK2SMOJAK2

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