SCHEMBL21574789

SCHEMBL21574789

COc1c(Cc2ccccc2)c(C(F)(F)F)nc2ccc(C(O)(c3ccc(Cn4cncc4C(O)(c4ccc5nc(C(F)(F)F)c(Cc6ccccc6)c(Cl)c5c4)c4ccccn4)cn3)c3cncn3C)cc12

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RORC P51449 20/20 0.60

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
SCHEMBL16633028 0.89 RORC (0.60) RORC
SCHEMBL16632673 0.88 RORC (0.65) RORC
SCHEMBL16639519 0.84 RORC (0.57) RORC
SCHEMBL16632809 0.82 RORC (0.76) RORC
SCHEMBL16632970 0.81 RORC (0.78) RORC
SCHEMBL16632939 0.80 RORC (0.81) RORC
SCHEMBL16633457 0.80 RORC (0.69) RORC
SCHEMBL16639565 0.80 RORC (0.61) RORC
SCHEMBL16632858 0.80 RORC (0.57) RORC
SCHEMBL16639483 0.80 RORC (0.73) 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