SCHEMBL22906559

SCHEMBL22906559

Cn1c2ccccc2c2cc(-c3ccc4c(c3)-c3ccccc3C4(C)C)ccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.44
MAPT P10636 3/20 0.43
KDM4E B2RXH2 4/20 0.43
HSD17B10 Q99714 3/20 0.43
ALDH1A1 P00352 3/20 0.43
HPGD P15428 3/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
PSEN1 P49768 2/20 0.40
PSEN2 P49810 2/20 0.40
APH1B Q8WW43 2/20 0.40
NCSTN Q92542 2/20 0.40
APH1A Q96BI3 2/20 0.40
PSENEN Q9NZ42 2/20 0.40
PABPC1 P11940 1/20 0.37
KIF11 P52732 1/20 0.36

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
SCHEMBL13433076 0.92 GPR3 (0.44) GPR3MAPTKDM4EHSD17B10ALDH1A1
SCHEMBL13487817 0.91 RXRA (0.38) GPR3MAPTKDM4EHSD17B10ALDH1A1
SCHEMBL13487552 0.91 RXRA (0.43) GPR3MAPTKDM4EHSD17B10ALDH1A1
SCHEMBL22705852 0.89 MAPT (0.38) GPR3MAPTKDM4EHSD17B10ALDH1A1
SCHEMBL21973023 0.88 MAPT (0.35) MAPTKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL22906682 0.88 RXRA (0.36) GPR3MAPTKDM4EHSD17B10ALDH1A1
SCHEMBL13487709 0.88 KDM4E (0.37) GPR3MAPTKDM4EHSD17B10ALDH1A1
SCHEMBL14478584 0.87 PDK2 (0.38) GPR3MAPTKDM4EHSD17B10ALDH1A1
SCHEMBL13487478 0.87 BCHE (0.39) GPR3MAPTKDM4EHSD17B10ALDH1A1
SCHEMBL21266405 0.86 TSPO (0.39) GPR3MAPTKDM4EHSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3647392-B1 LIGHT-EMITTING MATERIAL, COMPOUND, LONG-PERSISTENT PHOSPHOR AND LIGHT-EMITTING ELEMENT KYULUX INC (JP) 2021-09-08 EP disclosed
US-20210020851-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ORGANIC ELECTROLUMINESCENCE ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2021-01-21 US disclosed