SCHEMBL23636997

SCHEMBL23636997

CCC[C@@H]1CCN(c2ccc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)cc2)C1

nearest known ligand 0.50

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RORC P51449 19/20 0.50

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
SCHEMBL23632415 0.85 RORC (0.53) RORC
SCHEMBL23636848 0.82 HDAC3 (0.60) RORC
SCHEMBL21619885 0.82 RORC (0.52) RORC
SCHEMBL21619519 0.79 RORC (0.55) RORC
SCHEMBL21619482 0.79 RORC (0.55) RORC
SCHEMBL28917881 0.78 RORC (0.53) RORC
SCHEMBL23632703 0.78 RORC (0.51) RORC
SCHEMBL23636819 0.77 RORC (0.52) RORC
SCHEMBL23632655 0.77 RORC (0.52) RORC
SCHEMBL23632891 0.77 RORC (0.51) 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
WO-2021139599-A1 RORγT INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 东莞市东阳光新药研发有限公司 2021-07-15 WO disclosed