SCHEMBL22705708

SCHEMBL22705708

Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3cccc(-c4c5cccc(-c6cccc7c6c6ccccc6n7C)c5cc5c(-c6cccc7c6c6ccccc6n7C)cccc45)c32)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
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 5/20 0.31
HTT P42858 3/20 0.31
KDM4E B2RXH2 2/20 0.31
SMN1; SMN2 Q16637 3/20 0.31
MEN1 O00255 2/20 0.31
LMNA P02545 2/20 0.31
KMT2A Q03164 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
MAP3K5 Q99683 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
USP2 O75604 1/20 0.31
CASP1 P29466 1/20 0.31
BRCA1 P38398 1/20 0.31
RECQL P46063 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
SCHEMBL22706251 0.92 GPR3 (0.33) GPR3MAPTHTTKDM4ESMN1; SMN2
SCHEMBL22705678 0.90 GPR3 (0.37) BCHEACHENTRK1GPR3MAPT
SCHEMBL22707790 0.89 BCHE (0.34) BCHEACHENTRK1ESR1ESR2
SCHEMBL22705709 0.87 ALKBH5 (0.39) BCHEACHENTRK1ESR1ESR2
SCHEMBL22706892 0.87 KDM4E (0.33) ESR1ESR2KDM4EL3MBTL1RXFP1
SCHEMBL22705710 0.85 PSEN1 (0.34) BCHEACHENTRK1ESR1ESR2
SCHEMBL22705707 0.85 RXRA (0.35) BCHEACHENTRK1ESR1ESR2
SCHEMBL22705887 0.82 GPR3 (0.36) NTRK1GPR3MAPTHTTKDM4E
SCHEMBL22707140 0.82 GPR3 (0.36) NTRK1GPR3MAPTHTTKDM4E
SCHEMBL22706910 0.81 GPR3 (0.33) NTRK1GPR3MAPTHTTKDM4E

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