SCHEMBL20065568

SCHEMBL20065568

CC1(C)c2ccccc2N(c2ccccc2)c2cc(-c3cccc4c5c6ccccc6ccc5n(-c5nc(-c6ccccc6)cc(-c6ccc(-c7ccccc7)cc6)n5)c34)ccc21

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.33
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 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
SCHEMBL20065640 0.96 PDE6D (0.34) PDE6DKDM4EALDH1A1MAPTHPGD
SCHEMBL20065780 0.91 FLT3 (0.31) PDE6DKDM4EALDH1A1MAPTHPGD
SCHEMBL20066282 0.90 ALDH1A1 (0.32) PDE6DKDM4EALDH1A1MAPTHPGD
SCHEMBL20065570 0.90 PDE6D (0.32) PDE6DMAPT
SCHEMBL20066279 0.89 ALDH1A1 (0.33) PDE6DKDM4EALDH1A1MAPTHPGD
SCHEMBL20065653 0.89 PDE6D (0.34) PDE6D
SCHEMBL20065326 0.89 PTGES (0.31)
SCHEMBL20066284 0.89 PDE6D (0.32) PDE6D
SCHEMBL20065317 0.88 PTGES (0.31) KDM4EALDH1A1MAPTHPGD
SCHEMBL20066293 0.88 KDM4E (0.32) PDE6DKDM4EALDH1A1MAPTHPGD

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
WO-2018070835-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 주식회사 두산 2018-04-19 WO disclosed