SCHEMBL16888296

SCHEMBL16888296

N[C@H]1CC[C@@](c2ccc(C(OCc3c(F)cccc3F)(C(F)(F)F)C(F)(F)F)cc2)(S(=O)(=O)c2ccc(F)cc2)CC1

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 20/20 0.83
NR1I2 O75469 1/20 0.81

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
SCHEMBL18204941 1.00 RORC (0.83) RORCNR1I2
SCHEMBL16877049 1.00 RORC (0.83) RORCNR1I2
SCHEMBL16880387 0.95 RORC (0.86) RORCNR1I2
SCHEMBL16880558 0.91 RORC (0.92) RORCNR1I2
SCHEMBL16888285 0.91 RORC (1.00) RORCNR1I2
SCHEMBL16877014 0.91 RORC (1.00) RORCNR1I2
SCHEMBL16888284 0.91 RORC (1.00) RORCNR1I2
SCHEMBL16880331 0.91 RORC (1.00) RORCNR1I2
SCHEMBL16891798 0.89 RORC (1.00) RORCNR1I2
SCHEMBL16891760 0.89 RORC (1.00) RORCNR1I2

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-9708253-B2 Cyclohexyl sulfone RORγ modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2017-07-18 US disclosed
US-9708253-B2 Cyclohexyl sulfone RORγ modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2017-07-18 US disclosed
WO-2015103507-A1 CYCLOHEXYL SULFONE RORϒ MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-07-09 WO disclosed