SCHEMBL22707140

SCHEMBL22707140

Cn1c2ccccc2c2c(-c3cccc4c(-c5cccc6c5-c5ccccc5C65c6ccccc6-c6ccccc65)c5cccc(-c6cccc7c6c6ccccc6n7C)c5cc34)cccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.36
MAPT P10636 5/20 0.35
HTT P42858 3/20 0.35
NTRK1 P04629 2/20 0.33
NQO2 P16083 1/20 0.33
KDM4E B2RXH2 3/20 0.32
MAP3K5 Q99683 2/20 0.32
LMNA P02545 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
EGFR P00533 1/20 0.32
UTS2R Q9UKP6 1/20 0.32
USP2 O75604 1/20 0.32
CASP1 P29466 1/20 0.32
BRCA1 P38398 1/20 0.32
RECQL P46063 1/20 0.32
CASP7 P55210 1/20 0.32
YWHAG P61981 1/20 0.32

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
SCHEMBL22706442 0.92 GPR3 (0.33) GPR3MAPTHTTNTRK1NQO2
SCHEMBL22706910 0.92 GPR3 (0.33) GPR3MAPTHTTNTRK1NQO2
SCHEMBL22707207 0.91 NQO2 (0.32) GPR3MAPTHTTNTRK1NQO2
SCHEMBL22706275 0.89 MAPT (0.30) GPR3MAPTHTT
SCHEMBL22705678 0.89 GPR3 (0.37) GPR3MAPTHTTNTRK1NQO2
SCHEMBL22707790 0.89 BCHE (0.34) GPR3MAPTHTTNTRK1NQO2
SCHEMBL22707022 0.89 GPR3 (0.31) GPR3MAPTHTTNTRK1NQO2
SCHEMBL22707711 0.88 GPR3 (0.36) GPR3MAPTHTTNTRK1NQO2
SCHEMBL22707143 0.85 ALKBH5 (0.41) GPR3MAPTHTTNTRK1KDM4E
SCHEMBL22706251 0.85 GPR3 (0.33) GPR3MAPTHTTNQO2KDM4E

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