SCHEMBL21948924

SCHEMBL21948924

COc1ccc2c(-c3cc(N(C)Cc4ccccc4)n4ncc(C(=O)NC5CCC5O)c4n3)cn(C(C)C)c2n1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 0.72

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
SCHEMBL21963456 1.00 TYK2 (0.72) TYK2
SCHEMBL21948054 0.88 TYK2 (0.72) TYK2
SCHEMBL21948922 0.88 TYK2 (0.52) TYK2
SCHEMBL20689334 0.87 TYK2 (0.70) TYK2
SCHEMBL21238792 0.87 TYK2 (0.70) TYK2
SCHEMBL21947888 0.84 TYK2 (1.00) TYK2
SCHEMBL21947889 0.84 TYK2 (1.00) TYK2
SCHEMBL21961841 0.84 TYK2 (1.00) TYK2
SCHEMBL21948925 0.84 TYK2 (1.00) TYK2
SCHEMBL21947891 0.84 TYK2 (1.00) TYK2

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-2020081508-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2020-04-23 — — WO disclosed
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