SCHEMBL20149125

SCHEMBL20149125

CCNC(=O)N1C[C@@H](c2ccccc2)[C@H](c2ccc(C(O)(C(F)(F)F)C(F)(F)F)cc2)C1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 20/20 0.78
NR1I2 O75469 6/20 0.65

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
SCHEMBL23713111 0.87 RORC (1.00) RORCNR1I2
SCHEMBL20149585 0.85 RORC (1.00) RORCNR1I2
SCHEMBL23713002 0.85 RORC (1.00) RORCNR1I2
SCHEMBL20149087 0.82 RORC (0.75) RORCNR1I2
SCHEMBL20149047 0.82 RORC (0.90) RORCNR1I2
SCHEMBL20149131 0.79 RORC (0.93) RORCNR1I2
SCHEMBL23713068 0.79 RORC (1.00) RORCNR1I2
SCHEMBL23713042 0.78 RORC (1.00) RORCNR1I2
SCHEMBL20149112 0.78 RORC (1.00) RORC
SCHEMBL23713127 0.75 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018089406-A1 ROR GAMMA MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-17 WO disclosed