SCHEMBL3360732

SCHEMBL3360732

Cc1ccc(-c2cc3c(c(Nc4ccc(C5CCNCC5)c(C(F)(F)F)c4)n2)C(=O)[N]C=C3)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.38
CDK4 P11802 1/20 0.38
CDK6 Q00534 1/20 0.38
APP P05067 1/20 0.37
SYK P43405 8/20 0.34
NOTUM Q6P988 2/20 0.33
ALK Q9UM73 2/20 0.33
TLR9 Q9NR96 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
HTR1A P08908 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
WEE1 P30291 1/20 0.32
BRD4 O60885 1/20 0.32
ATAD2 Q6PL18 1/20 0.32
LCK P06239 1/20 0.32
PTK6 Q13882 1/20 0.32
AURKB Q96GD4 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
SCHEMBL3361975 0.90 KDR (0.38) SYK
SCHEMBL3363322 0.88 ZAP70 (0.38) CSF1RCDK4CDK6APPSYK
SCHEMBL27826573 0.80 CSF1R (0.37) CSF1RCDK4CDK6APPSYK
SCHEMBL1047719 0.80 ZAP70 (0.51) CSF1RCDK4CDK6APPSYK
SCHEMBL3361273 0.79 SYK (0.43) SYKWEE1BRD4
SCHEMBL3359095 0.79 ZAP70 (0.45) SYK
SCHEMBL1158187 0.78 SYK (0.40) CSF1RCDK4CDK6APPSYK
SCHEMBL3358576 0.77 ZAP70 (0.40) SYKBRD4
SCHEMBL3362371 0.76 SYK (0.38) CSF1RCDK4CDK6SYKWEE1
SCHEMBL3363275 0.75 ZAP70 (0.38) SYKWEE1LCK

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