SCHEMBL3457110

SCHEMBL3457110

CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(-c3ccccc3-c3ccncc3)cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 8/20 0.42
GCGR P47871 2/20 0.37
MAPK14 Q16539 1/20 0.37
CYP3A4 P08684 2/20 0.36
KCNQ2 O43526 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
CYP2D6 P10635 1/20 0.35
PTPN11 Q06124 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34
MMP2 P08253 2/20 0.33
MMP9 P14780 2/20 0.33
MMP8 P22894 2/20 0.33
MMP13 P45452 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 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
SCHEMBL3457057 0.94 PDK2 (0.39) PDK2GCGRMAPK14CYP3A4KCNQ2
SCHEMBL3456617 0.91 GCGR (0.37) PDK2GCGRMAPK14CYP3A4CYP2D6
SCHEMBL3456907 0.90 PDK2 (0.39) PDK2GCGRMAPK14CYP3A4TSHR
SCHEMBL8405373 0.87 CYP3A4 (0.44) PDK2GCGRMAPK14CYP3A4TSHR
SCHEMBL25357281 0.87 MMP2 (0.41) PDK2PTPN11MMP2MMP9MMP8
SCHEMBL1994589 0.87 PDK2 (0.41) PDK2PTPN11MMP2MMP9MMP8
SCHEMBL5660864 0.83 PDK2 (0.39) PDK2PTPN11MMP2MMP9MMP8
SCHEMBL5662403 0.83 PDK2 (0.39) PDK2PTPN11MMP2MMP9MMP8
SCHEMBL12668124 0.82 SOAT1 (0.36) PDK2
SCHEMBL19153489 0.82 CNR1 (0.41) PDK2PTPN11

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2264123-B1 PROCESS FOR THE PREPARATION OF SOLUTION-PROCESSABLE PHOSPHORESCENT MATERIALS CAMBRIDGE ENTPR LTD (GB) 2016-12-28 EP disclosed
EP-1501907-B1 SOLUTION-PROCESSABLE PHOSPHORESCENT MATERIALS CAMBRIDGE ENTPR LTD (GB) 2016-07-27 EP disclosed
US-9023978-B2 Solution-processable phosphorescent materials CAMBRIDGE ENTERPRISE LTD. (GB) 2015-05-05 US disclosed
EP-2264123-A2 Solution-processable phosphorescent materials Cambridge Display Technology Limited (GB) 2010-12-22 EP disclosed
US-20060063026-A1 Solution-processable phosphorescent materials CAMBRIDGE ENTERPRISE LTD (GB) 2006-03-23 US disclosed
EP-1501907-A2 SOLUTION-PROCESSABLE PHOSPHORESCENT MATERIALS CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LIMITED (GB) 2005-02-02 EP disclosed
WO-2003091355-A2 SOLUTION-PROCESSABLE PHOSPHORESCENT MATERIALS CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LIMITED (GB) 2003-11-06 WO disclosed