SCHEMBL6657774

SCHEMBL6657774

CCC1(CC)C=CC(C(=O)c2ccccc2)=CC1C(=O)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 10/20 0.35
HPGD P15428 5/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
MEN1 O00255 5/20 0.33
KMT2A Q03164 5/20 0.33
ELANE P08246 1/20 0.33
LMNA P02545 1/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
MAPT P10636 3/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
PGR P06401 1/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
HTR2A P28223 1/20 0.32
HRH1 P35367 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
SCHEMBL28895645 0.72 MEN1 (0.37) L3MBTL1ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL28552569 0.71 ALDH1A1 (0.39) L3MBTL1NPC1ALDH1A1HPGDRAB9A
SCHEMBL11227122 0.71 ALDH1A1 (0.39) L3MBTL1NPC1ALDH1A1HPGDRAB9A
SCHEMBL28541856 0.70 ALDH1A1 (0.37) L3MBTL1ALDH1A1HPGDRAB9ASMN1; SMN2
Benzophenone SCHEMBL8089683 0.67 ALDH1A1 (0.78) L3MBTL1NPC1ALDH1A1HPGDRAB9A
SCHEMBL29183161 0.67 ALDH1A1 (0.38) L3MBTL1NPC1ALDH1A1HPGDRAB9A
SCHEMBL4457422 0.67 NPC1 (0.35) L3MBTL1NPC1ALDH1A1SMN1; SMN2MEN1
SCHEMBL11139096 0.67 ELANE (0.40) L3MBTL1NPC1ALDH1A1HPGDRAB9A
SCHEMBL27617526 0.66 ALDH1A1 (0.37) L3MBTL1NPC1ALDH1A1HPGDRAB9A
SCHEMBL27747728 0.66 ALDH1A1 (0.37) L3MBTL1NPC1ALDH1A1HPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1153905-B1 NOVEL CRYSTALLINE ION-ASSOCIATION SUBSTANCE, PROCESS FOR PRODUCING THE SAME, AND POLYMERIZATION INITIATOR AUTEX INC (JP) 2004-08-04 EP disclosed
EP-1006119-B1 NOVEL CRYSTALLINE ION-ASSOCIATION SUBSTANCE, PROCESS FOR PRODUCING THE SAME, AND LATENT PHOTOPOLYMERIZATION INITIATOR AUTEX INC (JP) 2003-09-03 EP disclosed
US-6387975-B1 ORGANOMETALLIC COMPOUND COMPLEX AUTEX, INC. (JP) 2002-05-14 US disclosed
EP-1153905-A1 NOVEL CRYSTALLINE ION-ASSOCIATION SUBSTANCE, PROCESS FOR PRODUCING THE SAME, AND POLYMERIZATION INITIATOR AUTEX, INC. (JP) 2001-11-14 EP disclosed
EP-1006119-A1 NOVEL CRYSTALLINE ION-ASSOCIATION SUBSTANCE, PROCESS FOR PRODUCING THE SAME, AND LATENT PHOTOPOLYMERIZATION INITIATOR AUTEX, INC. (JP) 2000-06-07 EP disclosed