SCHEMBL8555922

SCHEMBL8555922

NS(=O)(=O)c1ccccc1-c1nc(COc2cccc(Cl)c2)oc1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.46
KMT2A Q03164 2/20 0.46
RXRA P19793 5/20 0.44
RXRB P28702 5/20 0.44
RXRG P48443 4/20 0.44
NR4A2 P43354 2/20 0.42
MAPT P10636 4/20 0.40
TSHR P16473 3/20 0.40
MAPK1 P28482 2/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
PPARD Q03181 3/20 0.40
FABP4 P15090 1/20 0.40
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RAB9A P51151 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 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
SCHEMBL8559017 0.92 KMT2A (0.46) TDP1KMT2ARXRARXRBRXRG
SCHEMBL8561919 0.90 NR4A2 (0.41) TDP1RXRARXRBRXRGNR4A2
SCHEMBL8557612 0.89 RXRA (0.43) TDP1KMT2ARXRARXRBRXRG
SCHEMBL8559035 0.88 GRM5 (0.41) RXRARXRBRXRGNR4A2PPARD
SCHEMBL8558559 0.87 NR4A2 (0.45) NR4A2PPARDFABP4RAB9A
SCHEMBL7496715 0.85 RXRA (0.47) TDP1KMT2ARXRARXRBRXRG
SCHEMBL7506528 0.85 RXRA (0.47) TDP1KMT2ARXRARXRBRXRG
SCHEMBL8558777 0.85 TDP1 (0.43) TDP1KMT2ARXRARXRBRXRG
SCHEMBL8555127 0.83 NPC1 (0.41) RXRARXRBRXRGNR4A2PPARD
SCHEMBL8556137 0.83 NR4A2 (0.47) KMT2ARXRARXRBRXRGNR4A2

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