SCHEMBL3360034

SCHEMBL3360034

Cc1cccc(-c2cc3c(c(Nc4ccc(OC5CCN(C)CC5)cc4)n2)C(=O)[N]C=C3)n1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 1/20 0.45
WEE1 P30291 1/20 0.42
ADORA2A P29274 4/20 0.38
HRH3 Q9Y5N1 2/20 0.37
AXL P30530 5/20 0.36
CAMK2D Q13557 1/20 0.36
ACACB O00763 1/20 0.36
EGFR P00533 1/20 0.34
ERBB2 P04626 1/20 0.34
GSK3B P49841 1/20 0.34
DYRK1A Q13627 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
AURKA O14965 1/20 0.34
CDK2 P24941 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
SCHEMBL3361998 0.88 ZAP70 (0.42) ZAP70WEE1EGFR
SCHEMBL3362577 0.82 DYRK1A (0.48) ZAP70WEE1AXLCAMK2DGSK3B
SCHEMBL3359787 0.79 SLC18A3 (0.36) ZAP70
SCHEMBL3359006 0.78 BTK (0.43) ZAP70AXLEGFR
SCHEMBL3360902 0.78 SYK (0.39) ZAP70EGFR
SCHEMBL3362356 0.78 BTK (0.38) ZAP70WEE1
SCHEMBL3362321 0.78 TGFBR1 (0.35) ZAP70HRH3EGFR
SCHEMBL3358792 0.77 ZAP70 (0.42) ZAP70WEE1EGFR
SCHEMBL1048535 0.77 ZAP70 (0.73) ZAP70WEE1ADORA2AAXL
SCHEMBL3359920 0.77 IGF1R (0.39) ZAP70CAMK2DEGFR

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 4 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
EP-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP disclosed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO disclosed