SCHEMBL3359219

SCHEMBL3359219

COCCN1CCC(c2ccc(Nc3nc(-c4cnc(C)nc4)cc4c3C(=O)[N]C=C4)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 4/20 0.41
SYK P43405 6/20 0.36
BRD4 O60885 1/20 0.35
ATAD2 Q6PL18 1/20 0.35
TLR9 Q9NR96 1/20 0.35
TLR8 Q9NR97 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
LRRK2 Q5S007 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
MAP3K12 Q12852 1/20 0.34
EGFR P00533 2/20 0.34
LCK P06239 1/20 0.34
JAK3 P52333 1/20 0.34
BTK Q06187 1/20 0.34
INSR P06213 1/20 0.33
ALK Q9UM73 1/20 0.33
CSF1R P07333 1/20 0.33
CHEK1 O14757 1/20 0.33

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
SCHEMBL3362166 0.92 ZAP70 (0.49) ZAP70SYKBRD4ATAD2TLR9
SCHEMBL3362296 0.89 ZAP70 (0.49) ZAP70BRD4
SCHEMBL3362930 0.85 TLR7 (0.36) ZAP70SYKBRD4ATAD2TLR9
SCHEMBL3362102 0.85 SYK (0.39) ZAP70SYKBRD4ATAD2LRRK2
SCHEMBL3362908 0.84 ZAP70 (0.37) ZAP70SYKBRD4ATAD2LRRK2
SCHEMBL3363030 0.84 ZAP70 (0.39) ZAP70SYKBRD4ATAD2MAP3K12
SCHEMBL3358208 0.84 TLR9 (0.40) ZAP70BRD4ATAD2TLR9TLR8
SCHEMBL3357921 0.83 ZAP70 (0.47) ZAP70BRD4EGFRLCKJAK3
SCHEMBL3358316 0.82 ZAP70 (0.39) ZAP70SYKBRD4EGFRJAK3
SCHEMBL3362467 0.81 ZAP70 (0.49) ZAP70BRD4

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 disclosed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO disclosed