SCHEMBL21606161

SCHEMBL21606161

CCn1nc(C(=O)NCC2CCC(S(C)(=O)=O)CC2)c(Cl)c1-c1cnc(NCCC2CC2)cc1OC(F)F

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 20/20 0.81

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
SCHEMBL21606030 0.95 RORC (0.80) RORC
SCHEMBL23219323 0.95 RORC (0.80) RORC
SCHEMBL21606189 0.94 RORC (0.81) RORC
SCHEMBL21606148 0.93 RORC (0.83) RORC
SCHEMBL21606156 0.92 RORC (0.81) RORC
SCHEMBL21606219 0.92 RORC (0.88) RORC
SCHEMBL23190170 0.90 RORC (1.00) RORC
SCHEMBL23190002 0.90 RORC (1.00) RORC
SCHEMBL23189970 0.90 RORC (1.00) RORC
SCHEMBL21606012 0.90 RORC (1.00) 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-2019244001-A1 6-AMINOPYRIDIN-3-YL PYRAZOLES AS MODULATORS OF RORYT JANSSEN PHARMACEUTICA NV (BE) 2019-12-26 — — WO disclosed
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