SCHEMBL21948030

SCHEMBL21948030

CO[C@]1(C)CCC[C@H](n2cccc(Nc3cc(N(C)C(=O)OC(C)(C)C)n4ncc(C(=O)NC5CC5)c4n3)c2=O)C1

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 0.74

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
SCHEMBL21948883 0.92 TYK2 (0.72) TYK2
SCHEMBL21948471 0.92 TYK2 (0.72) TYK2
SCHEMBL21948884 0.92 TYK2 (0.72) TYK2
SCHEMBL20697073 0.91 TYK2 (0.75) TYK2
SCHEMBL21238697 0.91 TYK2 (0.75) TYK2
SCHEMBL21948260 0.91 TYK2 (0.76) TYK2
SCHEMBL21961768 0.91 TYK2 (0.76) TYK2
SCHEMBL21948263 0.91 TYK2 (0.76) TYK2
SCHEMBL21961700 0.86 TYK2 (0.67) TYK2
SCHEMBL21947176 0.86 TYK2 (0.67) 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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