SCHEMBL8556828

SCHEMBL8556828

NS(=O)(=O)c1ccccc1-c1nc(C(F)F)oc1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP1 O94782 1/20 0.39
USP19 O94966 1/20 0.39
WDR48 Q8TAF3 1/20 0.39
ALOX5AP P20292 4/20 0.38
FEN1 P39748 4/20 0.38
NR4A2 P43354 3/20 0.37
CA1 P00915 4/20 0.36
CA2 P00918 4/20 0.36
CA12 O43570 3/20 0.36
CA9 Q16790 3/20 0.36
PTGS2 P35354 1/20 0.35
F10 P00742 1/20 0.35
MAOB P27338 3/20 0.34
RXRA P19793 2/20 0.34
RXRB P28702 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
RXRG P48443 1/20 0.34

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
SCHEMBL8561383 0.90 USP1 (0.39) USP1USP19WDR48ALOX5APFEN1
SCHEMBL8547032 0.85 NR4A2 (0.38) USP1USP19WDR48NR4A2PTGS2
SCHEMBL7499215 0.81 PTGS2 (0.54) CA1CA2CA12CA9PTGS2
SCHEMBL7508511 0.81 PTGS2 (0.54) CA1CA2CA12CA9PTGS2
SCHEMBL8560253 0.80 F10 (0.37) USP1USP19WDR48ALOX5APFEN1
SCHEMBL8555990 0.78 NR4A2 (0.62) USP1USP19WDR48NR4A2CA1
SCHEMBL8555628 0.78 USP1 (0.57) USP1USP19WDR48CA1CA2
SCHEMBL8139880 0.77 NR4A2 (0.55) NR4A2PTGS2RXRARXRBKDM4E
SCHEMBL8557933 0.77 NR4A2 (0.47) NR4A2PTGS2RXRARXRBKDM4E
SCHEMBL8560633 0.77 RXRA (0.47) NR4A2PTGS2RXRARXRBKDM4E

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