Sugi Predict

Sugi Predict / Compounds / SCHEMBL17033743

SCHEMBL17033743

SCHEMBL17033743

c1ccc(-c2ccc3c(c2)c2ccc4c(cc5c6ccccc6c6ccccc6n54)c2n3-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ TSPO P30536 1/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ NPY5R Q15761 1/20 0.31
▸ NR3C1 P04150 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
SCHEMBL17033747 0.97 KDM4E (0.38) PTGER4PDE10AKDM4EATML3MBTL1
SCHEMBL17033448 0.97 KDM4E (0.35) PTGER4PDE10AKDM4EATML3MBTL1
SCHEMBL17033459 0.95 KDM4E (0.35) PDE10AKDM4EATML3MBTL1KMT2A
SCHEMBL17033454 0.94 KDM4E (0.36) PDE10AKDM4EATML3MBTL1KMT2A
SCHEMBL17033725 0.94 MEN1 (0.34) PTGER4PDE10AKDM4EATML3MBTL1
SCHEMBL17033757 0.93 KDM4E (0.36) PTGER4PDE10AKDM4EATML3MBTL1
SCHEMBL17033441 0.91 KDM4E (0.34) PTGER4KDM4EATML3MBTL1KMT2A
SCHEMBL17033749 0.91 KDM4E (0.36) PTGER4PDE10AKDM4EATML3MBTL1
SCHEMBL17033745 0.89 HTR1A (0.35) NPY5R
SCHEMBL17033741 0.89 TSPO (0.34) PTGER4KDM4EATMTSPOKMT2A

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-2015125986-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 — — WO disclosed