SCHEMBL24716041

SCHEMBL24716041

CN1CCc2cc(Nc3ncc(Cl)c(Nc4ccccc4OC(F)F)n3)c(=O)n(C)c2C1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 1/20 0.56
▸ MAP4K1 Q92918 11/20 0.54
▸ ALK Q9UM73 7/20 0.54
▸ MET P08581 2/20 0.48
▸ INSR P06213 1/20 0.48
▸ AXL P30530 1/20 0.48

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
SCHEMBL24716030 0.95 LRRK2 (0.56) LRRK2MAP4K1ALKAXL
SCHEMBL24716358 0.84 LRRK2 (0.54) LRRK2MAP4K1ALKMET
SCHEMBL29869062 0.84 LRRK2 (0.54) LRRK2MAP4K1ALKMET
SCHEMBL24716031 0.84 MAP4K1 (0.71) MAP4K1ALKINSR
SCHEMBL24716047 0.79 MAP4K1 (0.54) MAP4K1ALKMETAXL
SCHEMBL24716908 0.78 MAP4K1 (0.53) MAP4K1ALKMETAXL
SCHEMBL24716378 0.78 MAP4K1 (0.53) MAP4K1ALKMETAXL
SCHEMBL24716377 0.78 ALK (0.60) MAP4K1ALKMETINSRAXL
SCHEMBL24715921 0.78 MAP4K1 (0.72) MAP4K1ALKINSR
SCHEMBL24716360 0.77 ALK (0.73) ALKMETINSR

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
Send feedback