SCHEMBL2746940

SCHEMBL2746940

CCCCOC(=O)c1coc2ccccc2c1=O

nearest known ligand 0.85

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.85
MAOA P21397 2/20 0.61
TSHR P16473 6/20 0.57
L3MBTL1 Q9Y468 3/20 0.57
TDP1 Q9NUW8 2/20 0.57
MAPK1 P28482 3/20 0.52
CYP3A4 P08684 2/20 0.52
TP53 P04637 1/20 0.52
ALDH1A1 P00352 5/20 0.52
KDM4E B2RXH2 2/20 0.52
LMNA P02545 2/20 0.51
HSD17B10 Q99714 1/20 0.51
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CHRNB2 P17787 1/20 0.48
CHRNA4 P43681 1/20 0.48

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
SCHEMBL18415630 0.86 MAOB (1.00) MAOBMAOATSHRL3MBTL1GAA
SCHEMBL13610199 0.85 MAOB (0.66) MAOBTSHRL3MBTL1TDP1MAPK1
SCHEMBL8712698 0.83 MAOB (0.59) MAOBMAOATSHRL3MBTL1TDP1
SCHEMBL10487735 0.81 MAOB (0.56) MAOBMAOATSHRL3MBTL1TDP1
SCHEMBL10381205 0.79 MAOB (0.71) MAOBMAOAL3MBTL1TP53ALDH1A1
SCHEMBL29671333 0.77 TSHR (0.77) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL16859557 0.77 TSHR (0.77) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL5259021 0.76 MAOB (0.81) MAOBMAOATSHRALDH1A1KDM4E
Dibutyl Phthalate SCHEMBL28218183 0.75 TSHR (0.93) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL10487743 0.75 MAOB (0.49) MAOBMAOATSHRL3MBTL1TDP1

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
US-20060131761-A1 Composition, method of authenticating, methods of making authenticatable compositions, authenticatable articles made there from SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2006-06-22 US claimed
US-8178702-B2 Composition, method of authenticating, methods of making authenticatable compositions, authenticatable articles made there from SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2012-05-15 US disclosed
US-20080265176-A1 COMPOSITION, METHOD OF AUTHENTICATING, METHODS OF MAKING AUTHENTICATABLE COMPOSITIONS, AUTHENTICATABLE ARTICLES MADE THERE FROM SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2008-10-30 US disclosed
US-20060131761-A1 Composition, method of authenticating, methods of making authenticatable compositions, authenticatable articles made there from SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2006-06-22 US disclosed