SCHEMBL6749775

SCHEMBL6749775

C#Cc1ccc2cc(OCc3ccccc3)ccc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.67
MAOB P27338 7/20 0.56
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51
PTGS1 P23219 1/20 0.51
SLC6A2 P23975 1/20 0.51
CYP2C19 P33261 1/20 0.51
PTGS2 P35354 1/20 0.51
SLC6A3 Q01959 1/20 0.51
HIF1A Q16665 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
LCK P06239 1/20 0.51
CYP3A4 P08684 1/20 0.51
MAOA P21397 3/20 0.50
RAB9A P51151 3/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NPC1 O15118 3/20 0.49

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
SCHEMBL227697 0.86 MAOB (0.67) ALOX5MAOBLMNACYP1A2PTGS1
SCHEMBL7837193 0.84 MAOB (0.75) ALOX5MAOBLMNACYP1A2PTGS1
SCHEMBL3571506 0.83 MAOB (0.57) ALOX5MAOBLMNACYP1A2PTGS1
SCHEMBL6100031 0.81 MAOB (0.71) ALOX5MAOBLMNACYP1A2PTGS1
SCHEMBL8984340 0.81 ALOX5 (0.92) ALOX5MAOBLMNACYP1A2PTGS1
SCHEMBL51460 0.81 ALOX5 (1.00) ALOX5MAOBLMNACYP1A2PTGS1
SCHEMBL28385012 0.80 MEN1 (0.54) ALOX5MAOBLMNACYP1A2PTGS1
SCHEMBL18297574 0.79 APP (0.60) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL28662350 0.79 ALOX5 (0.89) ALOX5MAOBLMNACYP1A2PTGS1
SCHEMBL4061647 0.77 ALOX5 (0.56) ALOX5MAOBLMNACYP1A2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6703082-B1 VARIOUS NAPHTHALENE-CONTAINING LIQUID CRYSTALS DISPLAYTECH, INC. 2004-03-09 US disclosed