SCHEMBL20002594

SCHEMBL20002594

CN(C)c1ccc(NC(=O)N2CCC(c3ccc(C(OCc4c(F)cccc4F)(C(F)(F)F)C(F)(F)F)cc3)([S+]([O-])c3ccc(F)cc3)C2)cc1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RORC P51449 20/20 0.73

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
SCHEMBL20002946 0.86 RORC (0.70) RORC
SCHEMBL20002129 0.85 RORC (0.61) RORC
SCHEMBL16886594 0.84 RORC (1.00) RORC
SCHEMBL20002941 0.83 RORC (0.71) RORC
SCHEMBL20002562 0.83 RORC (0.70) RORC
SCHEMBL20002528 0.82 RORC (0.70) RORC
SCHEMBL20002578 0.81 RORC (0.68) RORC
SCHEMBL20002634 0.81 RORC (0.70) RORC
SCHEMBL20002245 0.80 RORC (0.71) RORC
SCHEMBL20002518 0.80 RORC (0.66) 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