SCHEMBL24263313

SCHEMBL24263313

CNc1cc(Nc2cccn(-c3ccccn3)c2=O)nn2c(C(=O)N[C@@H]3CCCCN(C)C3=O)cnc12

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 0.76
▸ STAT3 P40763 1/20 0.60

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
SCHEMBL24263308 0.98 TYK2 (0.77) TYK2STAT3
SCHEMBL24263311 0.98 TYK2 (0.77) TYK2STAT3
SCHEMBL24263299 0.98 TYK2 (0.77) TYK2STAT3
SCHEMBL24263434 0.95 TYK2 (0.80) TYK2STAT3
SCHEMBL24263312 0.95 TYK2 (0.80) TYK2STAT3
SCHEMBL24263380 0.95 TYK2 (0.80) TYK2STAT3
SCHEMBL24263483 0.91 TYK2 (0.79) TYK2
SCHEMBL24263291 0.91 TYK2 (0.79) TYK2
SCHEMBL24263455 0.89 TYK2 (0.74) TYK2
SCHEMBL24263460 0.88 TYK2 (0.63) TYK2STAT3

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
Send feedback