SCHEMBL8558809

SCHEMBL8558809

CCOC(=O)Cc1nc(-c2ccccc2)c(-c2ccccc2S(N)(=O)=O)o1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 12/20 0.50
SMN1; SMN2 Q16637 1/20 0.48
RXRA P19793 6/20 0.47
RXRB P28702 4/20 0.47
NR4A1 P22736 3/20 0.47
NR4A3 Q92570 3/20 0.47
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.42

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
SCHEMBL8555035 0.92 NR4A2 (0.48) NR4A2SMN1; SMN2RXRARXRBNR4A1
SCHEMBL8556331 0.90 KDM4E (0.56) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8561179 0.89 NR4A2 (0.51) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8560614 0.88 RXRA (0.52) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8557634 0.86 NR4A2 (0.66) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL7499580 0.84 NR4A2 (0.55) NR4A2SMN1; SMN2RXRARXRBNR4A1
SCHEMBL7501262 0.84 NR4A2 (0.55) NR4A2SMN1; SMN2RXRARXRBNR4A1
SCHEMBL6315594 0.84 NR4A2 (0.59) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8555075 0.83 NR4A2 (0.47) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL8557768 0.83 NR4A2 (0.68) NR4A2SMN1; SMN2RXRARXRBNR4A1

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