SCHEMBL22103744

SCHEMBL22103744

CNC(=O)c1cnn2c(NC)cc(Nc3cccc4c3OCCC4)nc12

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 0.73
▸ STAT3 P40763 1/20 0.73
▸ PDE4D Q08499 1/20 0.50

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
SCHEMBL30377496 0.93 TYK2 (0.70) TYK2STAT3PDE4D
SCHEMBL22092666 0.93 TYK2 (0.70) TYK2STAT3PDE4D
SCHEMBL22342924 0.90 TYK2 (0.79) TYK2STAT3PDE4D
SCHEMBL29746781 0.90 TYK2 (0.79) TYK2STAT3PDE4D
SCHEMBL23327531 0.88 TYK2 (0.62) TYK2STAT3PDE4D
SCHEMBL30548465 0.88 TYK2 (0.62) TYK2STAT3PDE4D
SCHEMBL22092687 0.87 TYK2 (0.64) TYK2STAT3PDE4D
SCHEMBL22342927 0.87 TYK2 (0.65) TYK2STAT3
SCHEMBL29746837 0.87 TYK2 (0.65) TYK2STAT3
SCHEMBL22103745 0.86 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3894412-B1 7-(METHYLAMINO)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXAMIDE DERIVATIVES LILLY CO ELI (US) 2023-02-08 — — EP disclosed
WO-2020123225-A1 7-(METHYLAMINO)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2020-06-18 — — WO disclosed
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