SCHEMBL28830472

SCHEMBL28830472

CC(C)(C)OC(=O)N[C@H]1CCN(N=O)C1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.59
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
HSD11B1 P28845 9/20 0.50
CYP2C9 P11712 1/20 0.50
BTK Q06187 1/20 0.46
EPHX1 P07099 1/20 0.40
KCNA3 P22001 1/20 0.40
PIM1 P11309 1/20 0.40
PIM3 Q86V86 1/20 0.40
PIM2 Q9P1W9 1/20 0.40
BRD4 O60885 1/20 0.40
EPHX2 P34913 1/20 0.40

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
SCHEMBL23119939 1.00 CTSK (0.59) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL28830439 1.00 CTSK (0.59) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL31317827 0.91 CA1 (0.59) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL17951138 0.91 CA1 (0.59) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL31317808 0.91 CA1 (0.59) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL21882076 0.91 CTSK (0.55) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL28830425 0.87 CTSK (0.50) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL1959133 0.80 CTSK (0.64) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL428907 0.80 CTSK (0.64) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL359644 0.80 CTSK (0.64) CTSKCA1CA2HSD11B1CYP2C9

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-110724142-B Amide or sulfonamide substituted hydrazine derivatives as JAK kinase inhibitors 启元生物(杭州)有限公司 2022-09-02 CN disclosed
CN-110724142-A Amide or sulfonamide substituted hydrazine derivatives as JAK kinase inhibitors 维眸生物科技(上海)有限公司 2020-01-24 CN disclosed