Sugi Predict

Sugi Predict / Compounds / SCHEMBL9968219

SCHEMBL9968219

SCHEMBL9968219

CC(C)(C)Cc1cnc2c(c1)c1ccccc1n2-c1cccc(-c2cccc(-n3c4ccccc4c4cc(CC(C)(C)C)cnc43)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 11/20 0.36
▸ PTGER4 P35408 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PDE4A P27815 1/20 0.31
▸ PDE4B Q07343 1/20 0.31
▸ PDE4C Q08493 1/20 0.31
▸ PDE4D Q08499 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
SCHEMBL9968193 0.94 PTGER4 (0.37) PDE10APTGER4KDM4EATML3MBTL1
SCHEMBL8739893 0.81 KDM4E (0.41) KDM4EATML3MBTL1
SCHEMBL8739896 0.81 KDM4E (0.41) KDM4EATML3MBTL1
SCHEMBL10090525 0.79 KDM4E (0.41) PDE10AKDM4EATML3MBTL1PDE4A
SCHEMBL10090536 0.79 KDM4E (0.41) PDE10AKDM4EATML3MBTL1PDE4A
SCHEMBL18015505 0.78 ATM (0.43) PDE10AKDM4EATML3MBTL1
SCHEMBL22177160 0.78 KDM4E (0.48) KDM4EATML3MBTL1PDE4APDE4B
SCHEMBL10090549 0.75 ICMT (0.36) KDM4EATML3MBTL1
SCHEMBL23956208 0.75 GSK3B (0.40) PDE10APTGER4KDM4EATML3MBTL1
SCHEMBL13174410 0.75 KDM4E (0.39) KDM4EATML3MBTL1

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
US-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 — — US disclosed
US-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 — — US disclosed