SCHEMBL8555077

SCHEMBL8555077

Cc1nc(NS(=O)(=O)c2ccccc2)c(-c2ccc(F)cc2)o1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.51
PTGS1 P23219 2/20 0.51
MAPT P10636 3/20 0.49
HSD11B1 P28845 1/20 0.48
KDM4E B2RXH2 2/20 0.46
RXFP1 Q9HBX9 1/20 0.46
PTPN2 P17706 2/20 0.46
PTPN1 P18031 2/20 0.46
PTPN5 P54829 2/20 0.46
HSPD1 P10809 1/20 0.46
HSPE1 P61604 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
POLB P06746 1/20 0.45
TSHR P16473 1/20 0.43

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
SCHEMBL8554059 0.87 KDM1A (0.52) PTGS2MAPTHSD11B1KDM4ERXFP1
SCHEMBL8555624 0.85 MAPT (0.58) MAPTKDM4ERXFP1PTPN2PTPN1
SCHEMBL8559708 0.81 MAPT (0.46) PTGS2MAPTKDM4ERXFP1PTPN2
SCHEMBL8560329 0.81 PTGS2 (0.52) PTGS2PTGS1MAPTHSD11B1KDM4E
SCHEMBL8555123 0.76 AR (0.51) MAPTKDM4ERXFP1PTPN2PTPN1
SCHEMBL8473889 0.75 EDNRB (0.54) MAPTHSD11B1TSHR
SCHEMBL8556824 0.74 HSD11B1 (0.44) MAPTHSD11B1KDM4ERXFP1PTPN2
SCHEMBL8560251 0.74 HDAC6 (0.48) MAPTHSD11B1KDM4ERXFP1PTPN2
SCHEMBL8560630 0.74 MAPT (0.49) MAPTHSD11B1KDM4ERXFP1PTPN2
SCHEMBL8560574 0.73 MAPT (0.46) MAPTHSD11B1KDM4EPTPN2PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5719163-A ARTHRITIS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed