SCHEMBL24716367

SCHEMBL24716367

CCS(=O)(=O)c1c(C)cccc1Nc1nc(Nc2cc3c([nH]c2=O)CCN(C)C3)ncc1Cl

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 10/20 0.50
▸ ALK Q9UM73 4/20 0.48
▸ AXL P30530 3/20 0.47
▸ CCNK O75909 3/20 0.45
▸ CCND3 P30281 3/20 0.45
▸ CDK9 P50750 3/20 0.45
▸ CDK6 Q00534 3/20 0.45
▸ CCNA2 P20248 2/20 0.45
▸ CDK2 P24941 2/20 0.45
▸ MET P08581 1/20 0.42

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
SCHEMBL24716034 0.94 MAP4K1 (0.51) MAP4K1ALKAXLMET
SCHEMBL24716297 0.88 ALK (0.57) MAP4K1ALKAXL
SCHEMBL29869266 0.88 ALK (0.57) MAP4K1ALKAXL
SCHEMBL24716032 0.86 MAP4K1 (0.51) MAP4K1ALKAXLCCNKCCND3
SCHEMBL24716363 0.85 MAP4K1 (0.61) MAP4K1ALKAXLMET
SCHEMBL24716029 0.83 ALK (0.58) MAP4K1ALKAXLCDK9MET
SCHEMBL24715922 0.83 MAP4K1 (0.62) MAP4K1ALKMET
SCHEMBL24716366 0.82 ALK (0.60) MAP4K1ALKAXLCDK9MET
SCHEMBL29869267 0.82 ALK (0.60) MAP4K1ALKAXLCDK9MET
SCHEMBL24716027 0.82 MAP4K1 (0.54) MAP4K1ALKAXLMET

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
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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