SCHEMBL21574628

SCHEMBL21574628

CN(C)c1nc2ccc(C(O)(c3ccc(C(F)(F)F)nc3)c3cncn3C)cc2c(Cl)c1Cc1ccc(-n2cc(COc3nc4ccc(C(O)(c5ncccn5)c5cncn5C)cc4c(Cl)c3Cc3ccc(-n4cccn4)cc3)cn2)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
SCHEMBL16632751 0.89 RORC (0.88) RORC
SCHEMBL15649976 0.85 RORC (1.00) RORC
SCHEMBL16461827 0.85 RORC (1.00) RORC
SCHEMBL16461905 0.84 RORC (0.85) RORC
SCHEMBL21574729 0.84 RORC (0.60) RORC
SCHEMBL16632886 0.83 RORC (0.85) RORC
SCHEMBL16460883 0.83 RORC (1.00) RORC
SCHEMBL16639538 0.81 RORC (0.73) RORC
SCHEMBL16632687 0.81 RORC (0.85) RORC
SCHEMBL21574620 0.80 RORC (0.78) 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-3057951-B1 METHYLENE LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T JANSSEN PHARMACEUTICA NV (BE) 2019-11-20 EP disclosed