SCHEMBL11280393

SCHEMBL11280393

O=Cc1ccc2c(c1)Sc1cc(C=O)ccc1N2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 7/20 0.46
NOX1 Q9Y5S8 5/20 0.43
GAA P10253 3/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
PTGS2 P35354 2/20 0.41
CYP1A2 P05177 1/20 0.41
BCHE P06276 1/20 0.41
POLB P06746 1/20 0.41
CYP3A4 P08684 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
MAOA P21397 1/20 0.41
CNR1 P21554 1/20 0.41
ACHE P22303 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41

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
SCHEMBL31174399 0.91 NOX1 (0.59) SNCANOX1GAAMAPTMEN1
SCHEMBL30811560 0.91 NOX1 (0.59) SNCANOX1GAAMAPTMEN1
SCHEMBL4625689 0.91 NOX1 (0.59) SNCANOX1GAAMAPTMEN1
SCHEMBL11277664 0.83 NOX1 (0.43) SNCANOX1GAAMAPTMEN1
SCHEMBL11272621 0.80 NOX1 (0.59) SNCANOX1GAAMAPTMEN1
SCHEMBL8198004 0.79 SNCA (0.46) SNCANOX1GAAMAPTMEN1
SCHEMBL31083569 0.78 ALDH1A1 (0.50) TDP1PTGS2RAB9AALDH1A1KDM4E
SCHEMBL31083349 0.78 ALDH1A1 (0.50) TDP1PTGS2RAB9AALDH1A1KDM4E
SCHEMBL11391722 0.73 L3MBTL1 (0.64) SNCANOX1GAAMAPTMEN1
SCHEMBL8205041 0.73 SNCA (0.41) SNCANOX1GAAMAPTMEN1

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
CN-104357044-B A kind of fluorescent probe and its preparation method and application SHANGHAI UNIVERSITY OF ELECTRIC POWER (CN) 2016-04-13 CN claimed
CN-104357044-A Fluorescent probe as well as preparation method and application thereof UNIV SHANGHAI ELECTRIC POWER 2015-02-18 CN claimed
CN-108218867-A A kind of compound, organic electroluminescence device and display device 阜阳欣奕华材料科技有限公司 2018-06-29 CN disclosed
CN-104357044-A Fluorescent probe as well as preparation method and application thereof UNIV SHANGHAI ELECTRIC POWER 2015-02-18 CN disclosed
CN-1472203-A Two-photon initiator, synthetic method and microprocessing technology thereof 山东大学 2004-02-04 CN disclosed
US-4344956-A Oxotetrahydrothiophenes ERCOLI NICOLO 1982-08-17 US disclosed