SCHEMBL28557220

SCHEMBL28557220

COc1ccc(N(C)c2cc(Nc3ccccc3OC)nc3c(C(=O)NC4CCN(C)C4=O)cnn23)cc1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 19/20 0.71
▸ STAT3 P40763 4/20 0.71
▸ HPGDS O60760 1/20 0.45
▸ PDE4D Q08499 1/20 0.42

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
SCHEMBL21887786 0.90 TYK2 (0.69) TYK2STAT3HPGDS
SCHEMBL28641307 0.86 TYK2 (0.71) TYK2STAT3HPGDS
SCHEMBL30162010 0.84 TYK2 (0.62) TYK2STAT3HPGDSPDE4D
SCHEMBL21887371 0.84 TYK2 (0.62) TYK2STAT3HPGDSPDE4D
SCHEMBL30349442 0.84 TYK2 (0.77) TYK2STAT3PDE4D
SCHEMBL21887776 0.83 TYK2 (1.00) TYK2STAT3PDE4D
SCHEMBL21811269 0.83 TYK2 (1.00) TYK2STAT3PDE4D
SCHEMBL21811163 0.83 TYK2 (1.00) TYK2STAT3PDE4D
SCHEMBL30349436 0.83 TYK2 (1.00) TYK2STAT3PDE4D
SCHEMBL21887373 0.82 TYK2 (0.59) TYK2STAT3HPGDS

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
CN-112638915-B Pyrazolo [1,5-a ] pyrimidine-3-carboxamide derivatives for the treatment of psoriasis and systemic lupus erythematosus 伊莱利利公司 2023-04-07 — — CN disclosed
CN-112638915-A Pyrazolo [1,5-a ] pyrimidine-3-carboxamide derivatives for the treatment of psoriasis and systemic lupus erythematosus 伊莱利利公司 2021-04-09 — — CN disclosed
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