SCHEMBL7991966

SCHEMBL7991966

O=C1CCOc2cc3ccc(Br)cc3cc21

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.51
MAOA P21397 1/20 0.47
GRM5 P41594 7/20 0.41
PBRM1 Q86U86 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
NFKB1 P19838 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
BLM P54132 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
SCHEMBL2066249 0.82 MAOB (0.64) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL86452 0.82 MAOB (0.54) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL29982629 0.82 MAOB (0.54) MAOBMAOAGRM5PBRM1LMNA
SCHEMBL67609 0.82 MAOB (0.54) MAOBMAOAGRM5PBRM1LMNA
SCHEMBL29825555 0.82 MAOB (0.64) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL27942636 0.79 MAOB (0.60) MAOBMAOAGRM5NPC1ALDH1A1
Formaldehyde SCHEMBL28160192 0.79 MAOB (0.51) MAOBMAOAGRM5PBRM1LMNA
Formaldehyde SCHEMBL28233549 0.79 MAOB (0.60) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL32670081 0.77 MAOB (0.47) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL32670189 0.77 MAOB (0.47) MAOBMAOAGRM5NPC1ALDH1A1

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
US-6211385-B1 STARTING FROM THIOCHROMAN-4-ONE COMPOUND ALLERGAN SALES, INC. 2001-04-03 US disclosed
US-6043381-A Process for preparing substituted benzo[1,2-g]-chrom-3-ene, benzo[1,2-g]-thiochrom-3-ene and benzo[1,2-g]-1,2-dihydroquinoline derivatives ALLERGAN SALES, INC. (US) 2000-03-28 US disclosed