SCHEMBL22705709

SCHEMBL22705709

Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3cccc(-c4c5cccc(-c6cccc7c8ccccc8n(C)c67)c5cc5c(-c6cccc7c8ccccc8n(C)c67)cccc45)c32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 1/20 0.39
FTO Q9C0B1 1/20 0.39
IDO1 P14902 2/20 0.34
HSP90AA1 P07900 1/20 0.34
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
NTRK1 P04629 2/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
GPR3 P46089 1/20 0.31
MAPT P10636 4/20 0.31
KDM4E B2RXH2 3/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
HTT P42858 2/20 0.30
NPSR1 Q6W5P4 2/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
OPRK1 P41145 1/20 0.30
KMT2A Q03164 1/20 0.30
PRNP P04156 1/20 0.30

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
SCHEMBL22706248 0.92 ALKBH5 (0.39) ALKBH5FTOIDO1HSP90AA1GPR3
SCHEMBL22705683 0.90 ALKBH5 (0.42) ALKBH5FTOIDO1HSP90AA1NTRK1
SCHEMBL22706527 0.89 ALKBH5 (0.39) ALKBH5FTOIDO1HSP90AA1BCHE
SCHEMBL22705708 0.87 BCHE (0.34) BCHEACHENTRK1ESR1ESR2
SCHEMBL22706894 0.87 KDM4E (0.33) ESR1ESR2KDM4ELMNARXFP1
SCHEMBL22705710 0.85 PSEN1 (0.34) ALKBH5FTOBCHEACHENTRK1
SCHEMBL22705707 0.85 RXRA (0.35) ALKBH5FTOBCHEACHENTRK1
SCHEMBL22705890 0.82 ALKBH5 (0.41) ALKBH5FTOIDO1HSP90AA1NTRK1
SCHEMBL22707143 0.82 ALKBH5 (0.41) ALKBH5FTOIDO1HSP90AA1NTRK1
SCHEMBL20405059 0.81 ALKBH5 (0.49) ALKBH5FTOIDO1HSP90AA1BCHE

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
US-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 US disclosed