SCHEMBL3356864

SCHEMBL3356864

CCNc1cc2cc[nH]c(=O)c2c(Nc2ccc(N3CCOCC3)cc2)n1

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 14/20 0.78
JAK2 O60674 3/20 0.48
ADORA3 P0DMS8 1/20 0.48
TTBK1 Q5TCY1 1/20 0.45
TTBK2 Q6IQ55 1/20 0.45
SYK P43405 1/20 0.44
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL1045774 0.89 ZAP70 (0.75) ZAP70JAK2TTBK1TTBK2SYK
SCHEMBL1047738 0.88 ZAP70 (1.00) ZAP70JAK2TTBK1TTBK2SYK
SCHEMBL1049167 0.88 ZAP70 (0.68) ZAP70JAK2ADORA3SYK
SCHEMBL1048961 0.87 ZAP70 (0.69) ZAP70JAK2ADORA3SYK
SCHEMBL1045093 0.86 ZAP70 (0.72) ZAP70JAK2TTBK1TTBK2SYK
SCHEMBL1158186 0.83 ZAP70 (0.69) ZAP70JAK2TTBK1TTBK2SYK
SCHEMBL1049032 0.83 ZAP70 (0.72) ZAP70JAK2TTBK1TTBK2SYK
SCHEMBL1158001 0.82 ZAP70 (0.64) ZAP70JAK2TTBK1TTBK2
SCHEMBL1158422 0.82 ZAP70 (0.64) ZAP70JAK2TTBK1TTBK2SYK
SCHEMBL1045837 0.82 ZAP70 (0.67) ZAP70JAK2SYKMAPT

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