SCHEMBL22484433

SCHEMBL22484433

N#Cc1ccc2c(c1)-c1c(Cl)cccc1C21c2ccccc2Oc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.37
STK10 O94804 1/20 0.35
SLK Q9H2G2 1/20 0.35
PDK2 Q15119 2/20 0.33
IDO1 P14902 1/20 0.33
MDM2 Q00987 1/20 0.32
PIM1 P11309 1/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
PIM3 Q86V86 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
AR P10275 2/20 0.31
ABCC9 O60706 2/20 0.31
VNN1 O95497 1/20 0.31

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
SCHEMBL23257675 0.91 PDK2 (0.38) AHRSTK10SLKPDK2MDM2
SCHEMBL22484827 0.89 PDK2 (0.40) AHRSTK10SLKPDK2AR
SCHEMBL21702033 0.83 ABCC9 (0.41) AHRPDK2MDM2ABCC9
SCHEMBL22484968 0.82 STK10 (0.35) STK10SLKPDK2IDO1MDM2
SCHEMBL21701656 0.82 PDK2 (0.40) AHRSTK10SLKPDK2
SCHEMBL22891522 0.81 PDK2 (0.47) AHRPDK2
SCHEMBL21342650 0.81 AHR (0.40) AHRPDK2
SCHEMBL21343869 0.80 AHR (0.35) AHRSTK10SLKPDK2MDM2
SCHEMBL23372484 0.79 ABCC9 (0.39) AHRPDK2MDM2ABCC9
SCHEMBL21517337 0.78 PDK2 (0.42) AHRSTK10SLKPDK2IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020197170-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME 주식회사 엘지화학 2020-10-01 WO disclosed