SCHEMBL18685129

SCHEMBL18685129

CCC(=O)Nc1cccc2c(-c3ccnc(Nc4cn(C)nc4OC)n3)c[nH]c12

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 17/20 0.73
▸ JAK2 O60674 13/20 0.73
▸ TYK2 P29597 1/20 0.71
▸ JAK3 P52333 1/20 0.71
▸ EGFR P00533 1/20 0.57

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
SCHEMBL18685131 0.91 JAK1 (0.72) JAK1JAK2TYK2JAK3
SCHEMBL18668732 0.87 JAK1 (0.79) JAK1JAK2TYK2JAK3
SCHEMBL18662642 0.87 JAK1 (0.79) JAK1JAK2TYK2JAK3
SCHEMBL25407580 0.86 JAK1 (0.74) JAK1JAK2
SCHEMBL18662664 0.85 JAK1 (1.00) JAK1JAK2TYK2JAK3
SCHEMBL29392641 0.85 JAK1 (1.00) JAK1JAK2TYK2JAK3
SCHEMBL29466940 0.85 JAK1 (1.00) JAK1JAK2TYK2JAK3
SCHEMBL29394460 0.85 JAK1 (1.00) JAK1JAK2TYK2JAK3
SCHEMBL18662598 0.85 JAK1 (1.00) JAK1JAK2TYK2JAK3
SCHEMBL18662584 0.85 JAK1 (1.00) JAK1JAK2TYK2JAK3

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-4219482-A1 COMPOUNDS AND METHODS FOR INHIBITING JAK DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2023-08-02 — — EP disclosed
WO-2017050938-A1 COMPOUNDS AND METHODS FOR INHIBITING JAK ASTRAZENECA AB (SE) 2017-03-30 — — WO disclosed
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