SCHEMBL21090442

SCHEMBL21090442

CC(C)n1c(=O)c(NCc2ccc(S(C)=N)cc2)nc2cnc(Cl)nc21

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 19/20 0.44
▸ CDK1 P06493 1/20 0.39

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
SCHEMBL17168810 0.83 RORC (0.60) RORC
SCHEMBL17168858 0.83 RORC (0.59) RORC
SCHEMBL17171550 0.82 RORC (0.60) RORC
SCHEMBL17168862 0.82 RORC (0.60) RORC
SCHEMBL17168829 0.79 RORC (0.61) RORC
SCHEMBL21090727 0.79 RORC (0.44) RORC
SCHEMBL17171402 0.79 RORC (0.65) RORC
SCHEMBL25812631 0.77 RORC (0.57) RORC
SCHEMBL21090254 0.76 RORC (0.51) RORC
SCHEMBL17168765 0.75 RORC (0.67) 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-3131902-B1 COMPOUNDS AS MODULATORS OF ROR GAMMA BOEHRINGER INGELHEIM INT (DE) 2019-06-12 — — EP disclosed
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