SCHEMBL5015281

SCHEMBL5015281

O=c1nc(-c2cccc(CS(=O)(=O)O)n2)sc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.56
GABRA1 P14867 1/20 0.56
RAB9A P51151 9/20 0.38
SMN1; SMN2 Q16637 9/20 0.38
NPC1 O15118 8/20 0.38
ALDH1A1 P00352 6/20 0.38
NPSR1 Q6W5P4 5/20 0.38
KDM4E B2RXH2 5/20 0.38
MAPT P10636 4/20 0.38
RXFP1 Q9HBX9 3/20 0.38
KMT2A Q03164 3/20 0.38
LMNA P02545 3/20 0.38
NFKB1 P19838 2/20 0.38
NFKB2 Q00653 2/20 0.38
RELA Q04206 2/20 0.38
MEN1 O00255 1/20 0.38
RECQL P46063 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX12 P18054 1/20 0.38

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
SCHEMBL2955510 0.91 MIF (0.47) MIFGABRA1RAB9ASMN1; SMN2NPC1
SCHEMBL2962319 0.89 MIF (0.54) MIFGABRA1RAB9ASMN1; SMN2NPC1
SCHEMBL2962350 0.88 MIF (0.53) MIFGABRA1RAB9ASMN1; SMN2NPC1
SCHEMBL2959861 0.86 MIF (0.49) MIFGABRA1RAB9ASMN1; SMN2NPC1
SCHEMBL2956446 0.85 MIF (0.51) MIFGABRA1RAB9ASMN1; SMN2NPC1
SCHEMBL2961677 0.85 MIF (0.59) MIFGABRA1RAB9ASMN1; SMN2NPC1
SCHEMBL2960986 0.84 MIF (0.50) MIFGABRA1RAB9ASMN1; SMN2NPC1
SCHEMBL6605440 0.83 MIF (0.59) MIFGABRA1RAB9ASMN1; SMN2NPC1
SCHEMBL13199874 0.83 MIF (0.59) MIFGABRA1RAB9ASMN1; SMN2NPC1
SCHEMBL6605434 0.83 MIF (0.59) MIFGABRA1RAB9ASMN1; SMN2NPC1

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
US-7399759-B2 1, 3-benzothiazinone derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-15 US disclosed
EP-1424336-A1 1,3-BENZOTHIAZINONE DERIVATIVES AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2004-06-02 EP disclosed