SCHEMBL22707207

SCHEMBL22707207

Cn1c2ccccc2c2c(-c3cccc4c(-c5cccc6c5-c5ccccc5C65c6ccccc6-c6c5ccc5ccccc65)c5cccc(-c6cccc7c6c6ccccc6n7C)c5cc34)cccc21

nearest known ligand 0.32

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.32
GPR3 P46089 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
TOP2A P11388 1/20 0.31
GAA P10253 1/20 0.30
PKM P14618 1/20 0.30
CASP1 P29466 1/20 0.30
GALK1 P51570 1/20 0.30
BLM P54132 1/20 0.30
CASP7 P55210 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 1/20 0.30
SAE1 Q9UBE0 1/20 0.30
UBA2 Q9UBT2 1/20 0.30
NTRK1 P04629 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
SCHEMBL22707022 0.94 GPR3 (0.31) NQO2GPR3MAPTHTTTOP2A
SCHEMBL22705700 0.92 NQO2 (0.32) NQO2GPR3MAPTHTTTOP2A
SCHEMBL22707140 0.91 GPR3 (0.36) NQO2GPR3MAPTHTTTOP2A
SCHEMBL22706275 0.90 MAPT (0.30) GPR3MAPTHTT
SCHEMBL22707208 0.87 ALKBH5 (0.36) GPR3GAAPKMCASP1GALK1
SCHEMBL22706442 0.86 GPR3 (0.33) NQO2GPR3MAPTHTTTOP2A
SCHEMBL22706910 0.86 GPR3 (0.33) NQO2GPR3MAPTHTTTOP2A
SCHEMBL22707209 0.85 KDM4E (0.33) GPR3MAPTHTTKMT2AHSD17B10
SCHEMBL22706379 0.85 KDM4E (0.34)
SCHEMBL22707210 0.85 RXRA (0.35) GPR3MAPTGAAHSD17B10

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