SCHEMBL8560633

SCHEMBL8560633

CCc1nc(-c2ccccc2S(N)(=O)=O)c(-c2ccccc2)o1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 8/20 0.47
RXRB P28702 6/20 0.47
RXRG P48443 3/20 0.47
NR4A2 P43354 14/20 0.44
NR4A1 P22736 3/20 0.44
NR4A3 Q92570 3/20 0.44
PTGS1 P23219 2/20 0.42
PTGS2 P35354 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ABCC4 O15439 1/20 0.42
C5 P01031 1/20 0.42
LMNA P02545 1/20 0.42
CHRM2 P08172 1/20 0.42
CYP3A4 P08684 1/20 0.42
CHRM1 P11229 1/20 0.42
DRD2 P14416 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
TBXA2R P21731 1/20 0.42
HTR2A P28223 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
SCHEMBL8554938 0.90 RXRA (0.51) RXRARXRBRXRGNR4A2NR4A1
SCHEMBL8555075 0.90 NR4A2 (0.47) RXRARXRBRXRGNR4A2NR4A1
SCHEMBL8557933 0.87 NR4A2 (0.47) RXRARXRBRXRGNR4A2NR4A1
SCHEMBL8557473 0.86 NR4A2 (0.44) RXRARXRBRXRGNR4A2NR4A1
SCHEMBL8554884 0.85 NR4A2 (0.65) RXRARXRBRXRGNR4A2NR4A1
SCHEMBL8547023 0.85 RXRA (0.51) RXRARXRBRXRGNR4A2NR4A1
SCHEMBL8555236 0.85 NR4A2 (0.48) RXRARXRBRXRGNR4A2NR4A1
SCHEMBL8555035 0.83 NR4A2 (0.48) RXRARXRBRXRGNR4A2NR4A1
SCHEMBL8559929 0.83 RXRA (0.48) RXRARXRBRXRGNR4A2NR4A1
SCHEMBL8556748 0.83 RXRA (0.67) RXRARXRBRXRGNR4A2NR4A1

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