SCHEMBL24263430

SCHEMBL24263430

COc1ccc(CN(C)c2cc(Nc3cccn(-c4ccccn4)c3=O)nn3c(C(=O)NN4CCN(C)C4=O)cnc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 19/20 0.52
▸ STAT3 P40763 1/20 0.40
▸ JAK1 P23458 1/20 0.38

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
SCHEMBL24263534 0.89 TYK2 (0.54) TYK2JAK1
SCHEMBL24263286 0.88 TYK2 (0.55) TYK2JAK1
SCHEMBL31245725 0.88 TYK2 (0.55) TYK2JAK1
SCHEMBL24263518 0.88 TYK2 (0.55) TYK2JAK1
SCHEMBL24263278 0.88 TYK2 (0.56) TYK2STAT3
SCHEMBL24263421 0.87 TYK2 (0.55) TYK2STAT3
SCHEMBL24263289 0.86 TYK2 (0.54) TYK2STAT3
SCHEMBL18161079 0.86 TYK2 (0.69) TYK2JAK1
SCHEMBL24263282 0.85 TYK2 (0.52) TYK2JAK1
SCHEMBL31245741 0.85 TYK2 (0.52) TYK2JAK1

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