SCHEMBL21947294

SCHEMBL21947294

COC[C@H]1C[C@@H](n2cc(-c3cc(N(C)Cc4ccccc4)n4ncc(C(=O)N[C@H]5CC[C@@H]5OC)c4n3)c3cccnc32)C1

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 0.65

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
SCHEMBL21246130 0.94 TYK2 (0.66) TYK2
SCHEMBL20689534 0.94 TYK2 (0.66) TYK2
SCHEMBL21963213 0.92 TYK2 (0.67) TYK2
SCHEMBL21948516 0.92 TYK2 (0.67) TYK2
SCHEMBL21948562 0.92 TYK2 (0.77) TYK2
SCHEMBL21964846 0.92 TYK2 (0.77) TYK2
SCHEMBL21964845 0.89 TYK2 (0.69) TYK2
SCHEMBL21947281 0.89 TYK2 (0.62) TYK2
SCHEMBL21960681 0.89 TYK2 (0.62) TYK2
SCHEMBL21961785 0.89 TYK2 (0.75) 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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