SCHEMBL30290652

SCHEMBL30290652

COc1ccc(-c2n[nH]c3ncc(-c4ccc(N5CCN(C)CC5)cc4)cc23)cc1OC

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 20/20 0.70
IL2 P60568 5/20 0.70
LCK P06239 4/20 0.70
MAP4K3 Q8IVH8 4/20 0.70

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
SCHEMBL28692421 1.00 MAP4K1 (0.70) MAP4K1IL2LCKMAP4K3
SCHEMBL30290655 0.92 MAP4K1 (0.71) MAP4K1IL2LCKMAP4K3
SCHEMBL28674204 0.92 MAP4K1 (0.71) MAP4K1IL2LCKMAP4K3
SCHEMBL30290623 0.91 MAP4K1 (0.72) MAP4K1IL2LCKMAP4K3
SCHEMBL28684666 0.91 MAP4K1 (0.72) MAP4K1IL2LCKMAP4K3
SCHEMBL28667483 0.91 MAP4K1 (0.72) MAP4K1IL2LCKMAP4K3
SCHEMBL30290600 0.91 MAP4K1 (0.72) MAP4K1IL2LCKMAP4K3
SCHEMBL28667754 0.91 MAP4K1 (0.71) MAP4K1IL2LCKMAP4K3
SCHEMBL28683749 0.87 MAP4K1 (0.69) MAP4K1IL2LCKMAP4K3
SCHEMBL30290501 0.87 MAP4K1 (0.69) MAP4K1IL2LCKMAP4K3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113861188-B Pyrazolo [3,4-b ] pyridine derivative, preparation method thereof and application thereof as HPK1 inhibitor 杭州医学院 2023-02-28 CN disclosed