SCHEMBL12465942

SCHEMBL12465942

CCS(=O)(=O)c1ccc(CC(=O)Nc2cc(-c3cccc(F)c3)c(C(=O)c3ccccc3Cl)s2)cc1

nearest known ligand 0.86

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RORC P51449 20/20 0.86
RORB Q92753 2/20 0.62
NR1I2 O75469 1/20 0.62
RORA P35398 1/20 0.57

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
SCHEMBL12465929 0.92 RORC (1.00) RORCRORBNR1I2RORA
SCHEMBL12465750 0.92 RORC (0.80) RORCRORBNR1I2RORA
SCHEMBL12467545 0.91 RORC (0.88) RORCRORBNR1I2RORA
SCHEMBL12465858 0.90 RORC (0.82) RORCRORBNR1I2RORA
SCHEMBL12467562 0.89 RORC (0.84) RORCRORB
SCHEMBL12465760 0.88 RORC (0.82) RORCRORBNR1I2RORA
SCHEMBL12467518 0.87 RORC (1.00) RORCRORBNR1I2
SCHEMBL12467546 0.87 RORC (0.75) RORCRORBNR1I2RORA
SCHEMBL12465747 0.86 RORC (1.00) RORCRORBNR1I2
SCHEMBL12467507 0.85 RORC (0.85) RORCRORBNR1I2

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
WO-2012100732-A1 RETINOID-RELATED ORPHAN RECEPTOR GAMMA MODULATORS, COMPOSITION CONTAINING THEM AND USES THEREOF GLAXO GROUP LIMITED (GB) 2012-08-02 WO disclosed