SCHEMBL4456400

SCHEMBL4456400

Sc1ccccc1Cc1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
IDO1 P14902 2/20 0.43
MAPT P10636 1/20 0.43
CYP3A4 P08684 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
HIF1A Q16665 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PTGS2 P35354 1/20 0.40
KEAP1 Q14145 1/20 0.39
SLC6A4 P31645 3/20 0.39
SLC6A2 P23975 2/20 0.39
SLC6A3 Q01959 2/20 0.39
SIGMAR1 Q99720 1/20 0.38
SLC5A1 P13866 1/20 0.38
SLC5A2 P31639 1/20 0.38
MAOB P27338 1/20 0.37
DAO P14920 1/20 0.37

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
SCHEMBL38660310 1.00 MEN1 (0.43) MEN1KMT2AIDO1MAPTCYP3A4
SCHEMBL21380600 0.83 KEAP1 (0.42) KEAP1SLC6A4SLC6A2SLC6A3
SCHEMBL352619 0.82 CALM1 (0.52) MEN1KMT2AIDO1HPGD
SCHEMBL28231299 0.82 HPGD (0.38) MEN1KMT2AIDO1CYP3A4HPGD
SCHEMBL17415872 0.80 CALM1 (0.50) MEN1KMT2AIDO1HPGD
SCHEMBL28040183 0.80 CALM1 (0.50) MEN1KMT2AIDO1HPGD
SCHEMBL28039804 0.80 CALM1 (0.50) MEN1KMT2AIDO1HPGD
SCHEMBL28534680 0.79 IDO1 (0.43) MEN1KMT2AIDO1MAPTCYP3A4
SCHEMBL29153011 0.79 KEAP1 (0.39) IDO1KEAP1SLC6A4SLC6A2SLC6A3
SCHEMBL21669269 0.79 KEAP1 (0.39) IDO1CYP3A4KEAP1SLC6A4SLC6A2

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-112521240-B Synthesis method of asymmetric thioether 扬州大学 2023-06-30 CN claimed
CN-107022329-B Aqueous adhesive composition and use thereof 日东电工株式会社 2024-05-28 CN disclosed
EP-1524289-B1 POLYMERIZABLE COMPOSITION, OPTICAL MATERIAL COMPRISING THE COMPOSITION AND METHOD FOR PRODUCING THE MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2009-09-16 EP disclosed
US-20070149639-A1 Polymerizable composition, optical material comprising the composition and method for producing the material HORIKOSHI HIROSHI 2007-06-28 US disclosed
EP-1524289-A1 POLYMERIZABLE COMPOSITION, OPTICAL MATERIAL COMPRISING THE COMPOSITION AND METHOD FOR PRODUCING THE MATERIAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2005-04-20 EP disclosed
US-20040254258-A1 Polymerizable composition, optical material comprising the composition and method for producing the material MITSUBISHI GAS CHEMICAL CO., LTD. (JP) 2004-12-16 US disclosed