SCHEMBL24716375

SCHEMBL24716375

COc1nc2c(cc1Nc1ncc(Cl)c(Nc3ccccc3C(=O)N(C)C)n1)CN(C)CC2

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 6/20 0.62
▸ ALK Q9UM73 12/20 0.61
▸ INSR P06213 4/20 0.61
▸ IGF1R P08069 3/20 0.61
▸ AXL P30530 1/20 0.60
▸ MET P08581 3/20 0.55
▸ EGFR P00533 2/20 0.54
▸ MAPK8 P45983 1/20 0.50
▸ MAPK9 P45984 1/20 0.50
▸ MAPK10 P53779 1/20 0.50

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
SCHEMBL24716906 0.83 MAP4K1 (0.76) MAP4K1ALKINSRIGF1RMET
SCHEMBL24716026 0.82 AXL (0.60) MAP4K1ALKINSRIGF1RAXL
SCHEMBL24716294 0.82 MAP4K1 (0.54) MAP4K1ALKINSRIGF1RMET
SCHEMBL24716911 0.81 ALK (0.62) MAP4K1ALKINSRIGF1RAXL
SCHEMBL24394215 0.80 MAP4K1 (0.43) MAP4K1ALKINSRIGF1R
SCHEMBL24716373 0.78 ALK (0.58) MAP4K1ALKAXL
SCHEMBL29025264 0.78 MAP4K1 (0.46) MAP4K1ALK
SCHEMBL20214583 0.77 MAP4K1 (1.00) MAP4K1ALKINSRIGF1RMET
SCHEMBL25339375 0.76 MAP4K1 (0.61) MAP4K1ALKINSRIGF1RMET
SCHEMBL30446890 0.76 MAP4K1 (0.58) MAP4K1ALKINSRIGF1RMET

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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