SCHEMBL24716376

SCHEMBL24716376

CN1CCc2[nH]c(=O)c(Nc3ncc(Cl)c(Nc4ccccc4C(=O)O)n3)cc2C1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 7/20 0.61
▸ ALK Q9UM73 9/20 0.55
▸ MET P08581 8/20 0.55
▸ EGFR P00533 1/20 0.53
▸ AURKA O14965 1/20 0.53
▸ ULK1 O75385 1/20 0.49
▸ INSR P06213 1/20 0.49

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
SCHEMBL24716026 0.91 AXL (0.60) MAP4K1ALKMETEGFRINSR
SCHEMBL24716361 0.87 MAP4K1 (0.55) MAP4K1ALKMET
SCHEMBL24716363 0.87 MAP4K1 (0.61) MAP4K1ALKMET
SCHEMBL24715919 0.87 MAP4K1 (0.53) MAP4K1ALKMET
SCHEMBL29102658 0.86 MAP4K1 (0.52) MAP4K1ALKMET
SCHEMBL29869266 0.85 ALK (0.57) MAP4K1ALKAURKA
SCHEMBL24716297 0.85 ALK (0.57) MAP4K1ALKAURKA
SCHEMBL24716029 0.85 ALK (0.58) MAP4K1ALKMETAURKAINSR
SCHEMBL24716024 0.85 MAP4K1 (0.70) MAP4K1ALKEGFRINSR
SCHEMBL29869091 0.85 MAP4K1 (0.70) MAP4K1ALKEGFRINSR

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