SCHEMBL7796623

SCHEMBL7796623

Cc1c(C)c(OCc2ccccc2)c(C=CC(=O)c2ccc(OCc3ccccc3)cc2OCc2ccccc2)c(C)c1OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.51
MAOB P27338 2/20 0.47
MAPT P10636 2/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45
HDAC8 Q9BY41 1/20 0.44
SLC5A1 P13866 1/20 0.44
SLC5A2 P31639 1/20 0.44
CYSLTR2 Q9NS75 1/20 0.44
CYSLTR1 Q9Y271 1/20 0.44
ABCG2 Q9UNQ0 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
PKM P14618 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL7792876 0.96 APP (0.48) APPMAOBMAPTMEN1NPC1
SCHEMBL7786613 0.95 APP (0.53) APPMAOBMAPTMEN1NPC1
SCHEMBL7792948 0.95 APP (0.53) APPMAOBMAPTMEN1NPC1
SCHEMBL7792471 0.81 APP (0.41) APPMAOBMAPTMEN1NPC1
SCHEMBL7751091 0.80 HDAC8 (0.62) APPMAOBMAPTMEN1NPC1
SCHEMBL7751094 0.80 HDAC8 (0.62) APPMAOBMAPTMEN1NPC1
SCHEMBL3046003 0.80 APP (0.71) APPMAOBMAPTMEN1NPC1
SCHEMBL7796628 0.80 HDAC8 (0.56) APPMAOBMAPTMEN1NPC1
SCHEMBL12541737 0.79 ALOX5 (0.56) APPMAPTMEN1NPC1RAB9A
SCHEMBL12541741 0.79 ALOX5 (0.56) APPMAPTMEN1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0909267-B1 NOVEL 1,3-DIPHENYLPROPANE DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST TYROSINASE AND PROCESS FOR PREPARATION THEREOF LG CHEMICAL LTD (KR) 2001-11-21 EP disclosed
US-6093836-A INHIBITORY ACTIVITY AGAINT MELANIN BIOSYNTHESIS; WHITENING SUBSTANCES FOR MEDICAMENTS, COSMETICS LG CHEMICAL LTD. (KR) 2000-07-25 US disclosed
EP-0909267-A1 NOVEL 1,3-DIPHENYLPROPANE DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST TYROSINASE AND PROCESS FOR PREPARATION THEREOF LG CHEMICAL LIMITED (KR) 1999-04-21 EP disclosed
WO-1998039279-A1 NOVEL 1,3-DIPHENYLPROPANE DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST TYROSINASE AND PROCESS FOR PREPARATION THEREOF LG CHEMICAL LTD. (KR) 1998-09-11 WO disclosed