SCHEMBL23772359

SCHEMBL23772359

CNCCCNC(=O)c1cnn2c(NC)cc(Nc3cccn(-c4ccc(C)cn4)c3=O)nc12

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 19/20 0.62
▸ JAK1 P23458 1/20 0.56

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
SCHEMBL23772279 0.82 TYK2 (0.63) TYK2
SCHEMBL23753630 0.80 TYK2 (0.83) TYK2JAK1
SCHEMBL23772121 0.80 TYK2 (0.69) TYK2JAK1
SCHEMBL23772276 0.78 TYK2 (0.64) TYK2
SCHEMBL21726967 0.78 TYK2 (0.87) TYK2JAK1
SCHEMBL20697087 0.78 TYK2 (0.81) TYK2JAK1
SCHEMBL20678905 0.77 TYK2 (0.79) TYK2JAK1
SCHEMBL20688163 0.77 TYK2 (1.00) TYK2
SCHEMBL20688348 0.77 TYK2 (1.00) TYK2JAK1
SCHEMBL20688563 0.77 TYK2 (1.00) 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-2021162942-A1 7-(METHYLAMINO)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXAMIDE COMPOUNDS ELI LILLY AND COMPANY (US) 2021-08-19 — — WO disclosed
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