SCHEMBL20002925

SCHEMBL20002925

CC(C)(C)OC(=O)N1CCC(Sc2ccccc2)(c2ccc(C(O)(C(F)(F)F)C(F)(F)F)cc2)C1

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RORC P51449 20/20 0.64

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
SCHEMBL20002949 0.85 RORC (0.65) RORC
SCHEMBL20002405 0.82 RORC (0.69) RORC
SCHEMBL20002396 0.80 RORC (0.64) RORC
SCHEMBL20002950 0.79 RORC (0.65) RORC
SCHEMBL20003201 0.79 RORC (0.66) RORC
SCHEMBL16886446 0.78 RORC (1.00) RORC
SCHEMBL20003193 0.74 RORC (0.59) RORC
SCHEMBL20149117 0.71 RORC (1.00) RORC
SCHEMBL16875302 0.71 RORC (1.00) RORC
SCHEMBL16875299 0.71 RORC (1.00) RORC

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
EP-3092229-B1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS BRISTOL MYERS SQUIBB CO (US) 2018-03-28 EP disclosed