SCHEMBL24716309

SCHEMBL24716309

CCS(=O)(=O)c1ccccc1Nc1nc(Nc2cc3c(n(C)c2=O)CCN(C)C3)ncc1Cl

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 10/20 0.58
▸ AXL P30530 4/20 0.58
▸ MAP4K1 Q92918 6/20 0.55
▸ NEK2 P51955 1/20 0.51
▸ AURKA O14965 1/20 0.51
▸ AURKB Q96GD4 1/20 0.51

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
SCHEMBL24716377 0.92 ALK (0.60) ALKAXLMAP4K1NEK2AURKA
SCHEMBL24716393 0.91 ALK (0.55) ALKAXLMAP4K1NEK2AURKA
SCHEMBL24716036 0.89 MAP4K1 (0.53) ALKAXLMAP4K1
SCHEMBL24716365 0.89 AXL (0.73) ALKAXLMAP4K1NEK2AURKA
SCHEMBL24716360 0.89 ALK (0.73) ALK
SCHEMBL24716012 0.89 ALK (0.62) ALKAXLMAP4K1NEK2
SCHEMBL24716032 0.88 MAP4K1 (0.51) ALKAXLMAP4K1
SCHEMBL24716297 0.85 ALK (0.57) ALKAXLMAP4K1NEK2AURKA
SCHEMBL29869266 0.85 ALK (0.57) ALKAXLMAP4K1NEK2AURKA
SCHEMBL24716307 0.85 MAP4K1 (0.55) ALKAXLMAP4K1

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-116848103-A High activity HPK1 kinase inhibitors 杭州阿诺生物医药科技有限公司 2023-10-03 — — CN disclosed
WO-2022214008-A1 HIGHLY ACTIVE HPK1 KINASE INHIBITOR 杭州阿诺生物医药科技有限公司 2022-10-13 — — WO disclosed
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