SCHEMBL8557401

SCHEMBL8557401

NS(=O)(=O)c1ccccc1-c1oc(Cc2ccccc2)nc1-c1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 5/20 0.46
RXRA P19793 4/20 0.46
RXRB P28702 4/20 0.46
NR4A1 P22736 1/20 0.40
NR4A3 Q92570 1/20 0.40
RXRG P48443 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
CA1 P00915 4/20 0.37
CA2 P00918 4/20 0.37
CA12 O43570 3/20 0.37
CA9 Q16790 3/20 0.37
CA3 P07451 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
FAAH O00519 1/20 0.36
NR1H2 P55055 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
SCHEMBL8559346 0.95 NR4A2 (0.48) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8560078 0.91 NR4A2 (0.41) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8556383 0.90 NR4A2 (0.39) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8556401 0.90 CYP2C9 (0.40) NR4A2RXRARXRBALDH1A1MAPT
SCHEMBL8559383 0.90 RXRA (0.47) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8560396 0.89 NR4A2 (0.40) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8555966 0.88 CA12 (0.37) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8555541 0.88 NR4A2 (0.39) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8558703 0.88 RXRA (0.49) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8555989 0.88 NR4A2 (0.38) NR4A2RXRARXRBNR4A1NR4A3

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