SCHEMBL5052044

SCHEMBL5052044

[Li]c1ccc(-c2cccs2)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.52
DPP4 P27487 4/20 0.50
ALDH1A1 P00352 7/20 0.48
KDM4E B2RXH2 6/20 0.48
L3MBTL1 Q9Y468 4/20 0.48
GAA P10253 3/20 0.48
MAPT P10636 3/20 0.48
LMNA P02545 2/20 0.48
GLA P06280 2/20 0.48
MEN1 O00255 3/20 0.47
NPC1 O15118 3/20 0.47
HPGD P15428 3/20 0.47
RAB9A P51151 3/20 0.47
KMT2A Q03164 3/20 0.47
HSD17B10 Q99714 3/20 0.47
POLB P06746 2/20 0.47
CASP1 P29466 2/20 0.47
CASP7 P55210 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL13942801 0.83 DPP4 (0.65) LTA4HDPP4ALDH1A1KDM4EL3MBTL1
SCHEMBL13707354 0.83 DPP4 (0.65) LTA4HDPP4ALDH1A1KDM4EL3MBTL1
SCHEMBL14703073 0.83 DPP4 (0.65) LTA4HDPP4ALDH1A1KDM4EL3MBTL1
SCHEMBL499333 0.83 DPP4 (0.65) LTA4HDPP4ALDH1A1KDM4EL3MBTL1
SCHEMBL2742433 0.83 DPP4 (0.65) LTA4HDPP4ALDH1A1KDM4EL3MBTL1
SCHEMBL23611278 0.83 DPP4 (0.65) LTA4HDPP4ALDH1A1KDM4EL3MBTL1
SCHEMBL13707359 0.83 DPP4 (0.65) LTA4HDPP4ALDH1A1KDM4EL3MBTL1
Alpha-Terthienyl SCHEMBL147274 0.83 DPP4 (0.65) LTA4HDPP4ALDH1A1KDM4EL3MBTL1
SCHEMBL1105086 0.83 DPP4 (0.65) LTA4HDPP4ALDH1A1KDM4EL3MBTL1
SCHEMBL15957843 0.83 DPP4 (0.65) LTA4HDPP4ALDH1A1KDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1877462-A1 SEMICONDUCTORS CONTAINING PERFLUOROETHER ACYL OLIGOTHIOPHENE COMPOUNDS 3M Innovative Properties Company (US) 2008-01-16 EP disclosed
US-7211679-B2 Perfluoroether acyl oligothiophene compounds 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-01 US disclosed
US-7151276-B2 Semiconductors containing perfluoroether acyl oligothiophene compounds 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-12-19 US disclosed
WO-2006098859-A1 SEMICONDUCTORS CONTAINING PERFLUOROETHER ACYL OLIGOTHIOPHENE COMPOUNDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-09-21 WO disclosed
US-20060202191-A1 Semiconductors containing perfluoroether acyl oligothiohpene compounds 3M INNOVATIVE PROPERTIES COMPANY 2006-09-14 US disclosed
US-20060205172-A1 Perfluoroether acyl oligothiophene compounds 3M INNOVATIVE PROPERTIES COMPANY 2006-09-14 US disclosed