SCHEMBL27640285

SCHEMBL27640285

Cc1ccc2c(c1Cc1ccccc1)C(=O)c1ccccc1C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.46
MAOB P27338 2/20 0.41
IDH1 O75874 1/20 0.40
BCHE P06276 2/20 0.40
CES1 P23141 2/20 0.40
ACHE P22303 1/20 0.40
ALDH1A1 P00352 6/20 0.39
AKT1 P31749 1/20 0.38
AKT2 P31751 1/20 0.38
AKT3 Q9Y243 1/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
CASP3 P42574 1/20 0.38
HBB P68871 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38

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
SCHEMBL27640288 0.84 MAOA (0.47) MAOAMAOBBCHECES1ACHE
SCHEMBL9093467 0.77 MAOA (0.57) MAOAMAOBBCHECES1ACHE
SCHEMBL27640476 0.77 MAOA (0.52) MAOAMAOBBCHECES1ACHE
SCHEMBL10517737 0.76 CYP19A1 (0.44) MAOAMAOBBCHECES1CYP3A4
SCHEMBL28245197 0.75 MAOA (0.53) MAOAMAOBBCHECES1ACHE
SCHEMBL4652610 0.74 MAOA (0.61) MAOAMAOBBCHECES1ACHE
SCHEMBL30177232 0.74 MAOA (0.61) MAOAMAOBBCHECES1ACHE
SCHEMBL27640284 0.72 MAOA (0.46) MAOAMAOBBCHECES1ACHE
SCHEMBL28721340 0.71 MAOA (0.52) MAOAMAOBBCHECES1ACHE
SCHEMBL10756250 0.70 MAOA (0.55) MAOAMAOBBCHECES1ACHE

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
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