SCHEMBL28641308

SCHEMBL28641308

COc1ccc(CNc2cc(Nc3cccc4c3OCCC4)nc3c(C(=O)N[C@@H]4CCN(C)C4=O)cnn23)cc1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 0.76
▸ STAT3 P40763 4/20 0.76

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
SCHEMBL22092695 0.88 TYK2 (0.69) TYK2STAT3
SCHEMBL22092690 0.87 TYK2 (1.00) TYK2STAT3
SCHEMBL30377885 0.87 TYK2 (1.00) TYK2STAT3
SCHEMBL22103760 0.87 TYK2 (1.00) TYK2STAT3
SCHEMBL24224244 0.87 TYK2 (1.00) TYK2STAT3
SCHEMBL30349442 0.86 TYK2 (0.77) TYK2STAT3
SCHEMBL30378401 0.86 TYK2 (0.53) TYK2STAT3
SCHEMBL28641307 0.85 TYK2 (0.71) TYK2STAT3
SCHEMBL30377819 0.84 TYK2 (0.62) TYK2STAT3
SCHEMBL30378065 0.83 TYK2 (0.50) 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
CN-113166163-B 7- (methylamino) pyrazolo [1,5-A ] pyrimidine-3-carboxamide derivatives 伊莱利利公司 2023-04-07 — — CN disclosed
CN-113166163-A 7- (methylamino) pyrazolo [1,5-A ] pyrimidine-3-carboxamide derivatives 伊莱利利公司 2021-07-23 — — CN disclosed
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