SCHEMBL30521224

SCHEMBL30521224

CC1CC(c2cncc(NC(=O)c3cccn4ccnc34)c2)(c2nncn2C)C1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 18/20 0.48
▸ CBLC Q9ULV8 2/20 0.45
▸ CBL P22681 12/20 0.37
▸ TBK1 Q9UHD2 1/20 0.34

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
SCHEMBL31115377 0.86 CBLB (0.45) CBLBCBLCCBL
SCHEMBL31578110 0.82 CBLB (0.48) CBLBCBLCCBL
SCHEMBL31578307 0.82 CBLB (0.49) CBLBCBLCCBL
SCHEMBL31578100 0.81 CBLB (0.48) CBLBCBLCCBL
SCHEMBL31578230 0.81 CBLB (0.48) CBLBCBLCCBL
SCHEMBL31578213 0.79 CBLB (0.57) CBLBCBLCCBL
SCHEMBL31578191 0.78 CBLB (0.56) CBLBCBLCCBL
SCHEMBL30625596 0.75 CBLB (0.53) CBLBCBLCCBL
SCHEMBL30520871 0.75 CBLB (0.59) CBLBCBLCCBL
SCHEMBL31115418 0.75 CBLB (0.44) CBLBCBLCCBL

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118696043-A Heterocyclic compounds, compositions thereof and methods of treatment therewith 百济神州有限公司 2024-09-24 — — CN disclosed
WO-2023151640-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BEIGENE , LTD. (KY) 2023-08-17 — — WO disclosed
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