SCHEMBL24263303

SCHEMBL24263303

CNc1cc(Nc2cccc(C)n2)nn2c(C(=O)N[C@@H]3CN(C4CC4)C3=O)cnc12

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 20/20 0.55
PDE4D Q08499 2/20 0.52

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
SCHEMBL24263269 0.86 TYK2 (0.55) TYK2PDE4D
SCHEMBL24263301 0.81 TYK2 (0.79) TYK2
SCHEMBL30452187 0.81 TYK2 (0.52) TYK2PDE4D
SCHEMBL24263305 0.80 TYK2 (0.79) TYK2
SCHEMBL24263316 0.80 TYK2 (0.78) TYK2
SCHEMBL24263459 0.80 TYK2 (0.78) TYK2
SCHEMBL24263473 0.79 TYK2 (0.53) TYK2PDE4D
SCHEMBL24263516 0.78 TYK2 (0.60) TYK2PDE4D
SCHEMBL24263300 0.78 TYK2 (0.65) TYK2
SCHEMBL24263573 0.77 TYK2 (0.63) 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-2022037694-A1 A CLASS OF FIVE- AND SIX-MEMBERED HETEROCYCLIC COMPOUNDS AND USE THEREOF AS PROTEIN RECEPTOR KINASE INHIBITORS 轶诺(浙江)药业有限公司 2022-02-24 WO disclosed