SCHEMBL8427005

SCHEMBL8427005

CCCCn1c(-c2cc(C)cc(C)c2)c(C(C)C)c(=O)n([Se])c1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE9A O76083 1/20 0.36
RORA P35398 2/20 0.35
RORC P51449 2/20 0.35
RORB Q92753 2/20 0.35
PGR P06401 1/20 0.34
KDM4E B2RXH2 1/20 0.34
PDE4A P27815 2/20 0.34
PDE4B Q07343 2/20 0.34
PDE4C Q08493 2/20 0.34
PDE4D Q08499 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
RGS4 P49798 3/20 0.33
RGS8 P57771 2/20 0.33
LMNA P02545 2/20 0.33
TP53 P04637 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HPD P32754 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL8430906 0.88 LMNA (0.35) PDE9ARORARORCRORBPGR
SCHEMBL8428964 0.83 L3MBTL1 (0.38) KDM4EMEN1KMT2ALMNAL3MBTL1
SCHEMBL8426879 0.82 PGR (0.36) PDE9ARORARORCRORBPGR
SCHEMBL8430941 0.69 ALDH1A1 (0.38) RORARORCRORBPGRKDM4E
SCHEMBL11424517 0.67 RORA (0.39) RORARORCRORBPGRKDM4E
SCHEMBL8427006 0.62 MAPT (0.41) KDM4EPDE4APDE4BPDE4CPDE4D
SCHEMBL12752179 0.62 KMT2A (0.41) KDM4EPDE4APDE4BPDE4CPDE4D
SCHEMBL838929 0.58 RGS4 (0.58) RORARORCRORBPGRPDE4A
SCHEMBL8777494 0.58 TDP1 (0.68) RORARORCRORBPGRPDE4A
SCHEMBL10533316 0.57 ALDH1A1 (0.49) RORARORCRORBPGRKDM4E

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-5889013-A REACTING AN URACIL COMPOUND WITH N, O-BIS/TRIMETHYLSILYL/ACETAMIDE FOLLOWED BY TETRABUTYLAMMONIUM IODIDE AND CHLOROMETHYL ETHER COMPOUND AND THEN REACTING WITH ARYL SELENOL IN A BASE SUNKYONG INDUSTRIES CO., INC. (KR) 1999-03-30 US disclosed