SCHEMBL27640288

SCHEMBL27640288

O=C1c2ccccc2Cc2ccc(Cc3ccccc3)c(Cc3ccccc3)c21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.47
ELANE P08246 3/20 0.47
MAOB P27338 2/20 0.42
BCHE P06276 2/20 0.41
CES1 P23141 2/20 0.41
CTSG P08311 1/20 0.40
ALDH1A1 P00352 5/20 0.38
APAF1 O14727 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
MIF P14174 1/20 0.38
ACHE P22303 1/20 0.38
GAA P10253 1/20 0.37
CASP1 P29466 1/20 0.37
RAB9A P51151 1/20 0.37
BLM P54132 1/20 0.37
CASP7 P55210 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL10517737 0.91 CYP19A1 (0.44) MAOAELANEMAOBBCHECES1
SCHEMBL27640285 0.84 MAOA (0.46) MAOAELANEMAOBBCHECES1
SCHEMBL27640476 0.84 MAOA (0.52) MAOAELANEMAOBBCHECES1
SCHEMBL2127216 0.77 ELANE (0.69) MAOAELANEMAOBCTSGALDH1A1
SCHEMBL28826604 0.74 MAOA (0.47) MAOAELANEBCHECES1MIF
SCHEMBL8917078 0.73 DRD2 (0.46) MAOAELANECTSGALDH1A1APAF1
Hydrochloric Acid SCHEMBL9719382 0.73 TNF (0.48) MAOAELANEBCHECES1MIF
SCHEMBL27640284 0.73 MAOA (0.46) MAOAELANEMAOBBCHECES1
SCHEMBL22720620 0.73 PNMT (0.46) ELANECTSGALDH1A1APAF1MAPT
SCHEMBL13935793 0.72 ELANE (0.67) MAOAELANEMAOBBCHECES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100509740-C 10,10-dibenzyl anthrone and derivative and synthetic method thereof GUANGZHOU INST OF CHEMISTRY (CN) 2009-07-08 CN claimed
CN-100509740-C 10,10-dibenzyl anthrone and derivative and synthetic method thereof GUANGZHOU INST OF CHEMISTRY (CN) 2009-07-08 CN disclosed
CN-1858033-A 10,10-dibenzyl anthrone and its derivative and synthetic method GUANGZHOU INST CHEMISTRY CAS (CN) 2006-11-08 CN disclosed