SCHEMBL21948284

SCHEMBL21948284

CO[C@@H]1CCCC(NC(=O)c2cnn3c(N(C)C(=O)OC(C)(C)C)cc(Nc4cccn([C@H]5C[C@@H](OC)C5)c4=O)nc23)C1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 0.73

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
SCHEMBL21947221 1.00 TYK2 (0.73) TYK2
SCHEMBL21961742 0.96 TYK2 (0.68) TYK2
SCHEMBL21947176 0.94 TYK2 (0.67) TYK2
SCHEMBL21961700 0.94 TYK2 (0.67) TYK2
SCHEMBL21238720 0.94 TYK2 (0.74) TYK2
SCHEMBL20689678 0.94 TYK2 (0.74) TYK2
SCHEMBL21948501 0.92 TYK2 (0.72) TYK2
SCHEMBL21947220 0.92 TYK2 (0.74) TYK2
SCHEMBL21948231 0.92 TYK2 (0.74) TYK2
SCHEMBL21960643 0.92 TYK2 (0.60) 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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