SCHEMBL8556041

SCHEMBL8556041

NS(=O)(=O)c1ccccc1-c1nc(Cc2ccccc2)oc1-c1cc(Cl)cc(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRA P19793 13/20 0.47
RXRB P28702 13/20 0.47
RXRG P48443 10/20 0.47
NR4A2 P43354 4/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 2/20 0.36
MAOB P27338 1/20 0.35
FBP1 P09467 1/20 0.35
FAAH O00519 1/20 0.35

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
SCHEMBL8556149 0.92 RXRA (0.49) RXRARXRBRXRGNR4A2ALDH1A1
SCHEMBL8557928 0.91 RXRA (0.47) RXRARXRBRXRGNR4A2ALDH1A1
SCHEMBL8560340 0.90 RXRA (0.46) RXRARXRBRXRGNR4A2ALDH1A1
SCHEMBL8557473 0.89 NR4A2 (0.44) RXRARXRBRXRGNR4A2ALDH1A1
SCHEMBL8560006 0.87 RXRA (0.48) RXRARXRBRXRGNR4A2LMNA
SCHEMBL8558000 0.87 RXRA (0.47) RXRARXRBRXRGNR4A2ALDH1A1
SCHEMBL8555554 0.87 RXRA (0.47) RXRARXRBRXRGNR4A2ALDH1A1
SCHEMBL8555918 0.86 RXRA (0.38) RXRARXRBRXRGNR4A2ALDH1A1
SCHEMBL8560396 0.86 NR4A2 (0.40) RXRARXRBRXRGNR4A2ALDH1A1
SCHEMBL8559346 0.85 NR4A2 (0.48) RXRARXRBRXRGNR4A2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5719163-A ARTHRITIS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed
EP-0699192-A1 SUBSTITUTED OXAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-03-06 EP disclosed
WO-1994027980-A1 SUBSTITUTED OXAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1994-12-08 WO disclosed