SCHEMBL24716031

SCHEMBL24716031

CN1CCc2cc(Nc3ncc(Cl)c(Nc4ccccc4P(C)(C)=O)n3)c(=O)n(C)c2C1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 16/20 0.71
▸ EGFR P00533 2/20 0.60
▸ INSR P06213 2/20 0.59
▸ IGF1R P08069 2/20 0.59
▸ ALK Q9UM73 2/20 0.59

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
SCHEMBL24715921 0.94 MAP4K1 (0.72) MAP4K1EGFRINSRIGF1RALK
SCHEMBL24716035 0.88 MAP4K1 (0.68) MAP4K1EGFRINSRIGF1RALK
SCHEMBL20214787 0.86 MAP4K1 (0.84) MAP4K1EGFRINSRIGF1RALK
SCHEMBL24039985 0.86 MAP4K1 (0.84) MAP4K1EGFRINSRIGF1RALK
SCHEMBL24715910 0.84 MAP4K1 (0.68) MAP4K1EGFRINSRIGF1RALK
SCHEMBL20214480 0.84 MAP4K1 (0.81) MAP4K1EGFRINSRIGF1RALK
SCHEMBL24715914 0.84 MAP4K1 (0.60) MAP4K1EGFR
SCHEMBL24715911 0.84 MAP4K1 (0.59) MAP4K1EGFRINSRIGF1RALK
SCHEMBL24716041 0.84 LRRK2 (0.56) MAP4K1INSRALK
SCHEMBL24715916 0.84 MAP4K1 (0.71) MAP4K1EGFRINSRIGF1RALK

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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