SCHEMBL3393473

SCHEMBL3393473

Clc1ccccc1-c1cc2c(c(Nc3cccc(OCCN4CCOCC4)c3)n1)CNC=C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.46
AIMP2 Q13155 2/20 0.43
EPHX2 P34913 3/20 0.42
SRC P12931 1/20 0.42
EGFR P00533 3/20 0.42
BTK Q06187 1/20 0.42
MAPK14 Q16539 1/20 0.40
PRKCQ Q04759 2/20 0.40
PIM1 P11309 1/20 0.40
FLT3 P36888 1/20 0.40
PIM3 Q86V86 1/20 0.40
BAD Q92934 1/20 0.40
PIM2 Q9P1W9 1/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
TSHR P16473 2/20 0.40
TP53 P04637 1/20 0.40
GRK2 P25098 1/20 0.40
CYP1A2 P05177 1/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL1047916 0.79 ZAP70 (0.65) SYKAIMP2EPHX2SRCEGFR
SCHEMBL3394570 0.76 ZAP70 (0.55) KDM4ETSHR
SCHEMBL3360206 0.74 ZAP70 (0.42) SYKBTK
SCHEMBL12929344 0.71 SYK (0.49) SYKAIMP2SRCEGFRBTK
SCHEMBL14578174 0.71 EPHX2 (0.61) SYKEPHX2SRCKDM4EALDH1A1
SCHEMBL488950 0.69 MET (0.57) SYKAIMP2EPHX2SRCEGFR
SCHEMBL3459344 0.68 SRC (0.59) SYKAIMP2EPHX2SRCEGFR
SCHEMBL3360194 0.68 SRC (0.46) SYKAIMP2EPHX2SRCEGFR
SCHEMBL4209736 0.67 EPHX2 (0.54) SYKAIMP2EPHX2SRCEGFR
SCHEMBL3359769 0.67 SYK (0.43) SYKAIMP2EPHX2SRCEGFR

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