SCHEMBL28786261

SCHEMBL28786261

Cc1cccc2nc(-c3ccccc3Cl)c(CCBr)nc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 11/20 0.50
RAB9A P51151 2/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
MGAM O43451 1/20 0.45
GAA P10253 1/20 0.45
SI P14410 1/20 0.45
MGAM2 Q2M2H8 1/20 0.45
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
GLA P06280 1/20 0.39
NPC1 O15118 1/20 0.38
GPR55 Q9Y2T6 1/20 0.38
MAPK13 O15264 1/20 0.37
MAPK12 P53778 1/20 0.37
MAPK11 Q15759 1/20 0.37
MAPK14 Q16539 1/20 0.37
ELANE P08246 1/20 0.36
PIM1 P11309 1/20 0.36

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
SCHEMBL1598249 0.90 PIK3CD (0.49) PIK3CDRAB9AMAPTMAPK1MGAM
SCHEMBL4174724 0.84 PIK3CD (0.52) PIK3CDRAB9AMAPTMAPK1MGAM
SCHEMBL13973985 0.84 PIK3CD (0.49) PIK3CDRAB9AMAPTMAPK1MGAM
SCHEMBL1598282 0.84 MAPT (0.48) PIK3CDRAB9AMAPTMAPK1MGAM
SCHEMBL13973986 0.79 MAPT (0.48) PIK3CDRAB9AMAPTMAPK1MGAM
SCHEMBL4169571 0.79 MAPT (0.48) PIK3CDRAB9AMAPTMAPK1MGAM
SCHEMBL1599020 0.78 KDM4E (0.44) PIK3CDRAB9AMAPTMGAMGAA
SCHEMBL1598069 0.74 ALDH1A1 (0.40) PIK3CDRAB9AGAAKMT2AKDM4E
SCHEMBL4173738 0.73 PIK3CD (0.47) PIK3CDRAB9AMAPTMAPK1MGAM
SCHEMBL14047376 0.72 KDM4E (0.44) PIK3CDRAB9AMGAMGAASI

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
CN-101715453-B Heterocyclic compounds and their uses AMGEN INC 2012-06-27 CN disclosed
CN-101715453-A Heterogeneous ring compound and application thereof AMGEN INC 2010-05-26 CN disclosed