SCHEMBL24745797

SCHEMBL24745797

CCNC(=O)c1ccc(Nc2nc(-c3c(F)cccc3F)cc3nc[nH]c(=O)c23)cc1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 12/20 0.46
JAK2 O60674 9/20 0.46
JAK1 P23458 1/20 0.46
JAK3 P52333 1/20 0.46
AURKA O14965 1/20 0.40
PARP1 P09874 1/20 0.38
ZAP70 P43403 1/20 0.37

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
SCHEMBL29891257 1.00 TYK2 (0.46) TYK2JAK2JAK1JAK3AURKA
SCHEMBL24745848 0.85 ZAP70 (0.50) TYK2JAK2JAK1JAK3ZAP70
SCHEMBL24746089 0.84 TYK2 (0.52) TYK2JAK2JAK1JAK3
SCHEMBL24745795 0.82 TYK2 (0.41) TYK2AURKAZAP70
SCHEMBL24746092 0.79 TYK2 (0.51) TYK2JAK2JAK1JAK3
SCHEMBL30316492 0.79 TYK2 (0.51) TYK2JAK2JAK1JAK3
SCHEMBL29891348 0.71 TYK2 (0.42) TYK2JAK2JAK1JAK3ZAP70
SCHEMBL17054845 0.69 TYK2 (0.80) TYK2JAK2
SCHEMBL24747221 0.69 TYK2 (0.76) TYK2JAK2JAK1JAK3AURKA
SCHEMBL1058726 0.68 ZAP70 (0.59) JAK2ZAP70

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-117120090-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2023-11-24 CN disclosed
WO-2022174253-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2022-08-18 WO disclosed