Phenoxathiine

Phenoxathiine

SCHEMBL28774348

O=[Ti]=O.c1ccc2c(c1)Oc1ccccc1S2

nearest known ligand 0.81

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.38
MAOA P21397 4/20 0.36
BCHE P06276 3/20 0.36
MAOB P27338 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ACHE P22303 2/20 0.36
ALOX5 P09917 1/20 0.36
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
CYP3A4 P08684 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
CNR1 P21554 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36
HTR2C P28335 1/20 0.36

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
Phenoxathiine SCHEMBL7922 0.90 MAOA (0.42) ATMMAOABCHEMAOBMEN1
Phenoxathiine SCHEMBL29396568 0.90 MAOA (0.42) ATMMAOABCHEMAOBMEN1
Phenoxathiine SCHEMBL29373698 0.90 MAOA (0.42) ATMMAOABCHEMAOBMEN1
Phenoxathiine SCHEMBL5970725 0.87 MAOA (0.40) ATMMAOABCHEMAOBMEN1
Phenoxathiine SCHEMBL5699627 0.87 MAOA (0.40) ATMMAOABCHEMAOBMEN1
SCHEMBL19205828 0.87 AHR (0.41) ATMMAOABCHEMAOBMEN1
Phenoxathiine SCHEMBL10512948 0.87 MAOA (0.40) ATMMAOABCHEMAOBMEN1
Phenoxathiine SCHEMBL11361322 0.85 MAOA (0.39) ATMMAOABCHEMAOBMEN1
Phenoxathiine SCHEMBL11361313 0.85 MAOA (0.39) ATMMAOABCHEMAOBMEN1
Phenoxathiine SCHEMBL11361319 0.83 MAOA (0.37) ATMMAOABCHEMAOBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101213241-B Polymeric materials VICTREX MFG LTD 2012-07-04 CN disclosed
CN-101213241-A Polymeric materials VICTREX MFG LTD (GB) 2008-07-02 CN disclosed