SCHEMBL21574763

SCHEMBL21574763

CCc1nc2ccc(C(c3cnc(C)n3C)c3cnc(C)n3C)cc2c(C)c1Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 15/20 0.47
CNR1 P21554 5/20 0.35

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
SCHEMBL21574678 0.84 RORC (0.50) RORC
SCHEMBL21076057 0.83 RORC (0.55) RORC
SCHEMBL16632708 0.82 RORC (0.58) RORC
SCHEMBL21574695 0.80 RORC (0.36) RORCCNR1
SCHEMBL21538872 0.79 RORC (0.35) RORC
SCHEMBL16641815 0.77 RORC (0.54) RORC
SCHEMBL21574565 0.76 CYP1A2 (0.41) RORC
SCHEMBL21574700 0.76 RORC (0.45) RORCCNR1
SCHEMBL16640834 0.74 RORC (0.55) RORC
SCHEMBL21075983 0.74 RORC (0.55) 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