SCHEMBL31115323

SCHEMBL31115323

Cn1cnnc1CC1(c2cccc(NC(=O)c3ccc4c(n3)CCN4)c2)CC(C#N)C1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 20/20 0.66
▸ CBL P22681 1/20 0.47

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
SCHEMBL25360930 0.86 CBLB (0.65) CBLBCBL
SCHEMBL23002279 0.81 CBLB (0.72) CBLBCBL
SCHEMBL23002277 0.81 CBLB (0.72) CBLBCBL
SCHEMBL30540574 0.80 CBLB (0.56) CBLB
SCHEMBL23002243 0.80 CBLB (1.00) CBLB
SCHEMBL22695643 0.80 CBLB (1.00) CBLB
SCHEMBL22695549 0.80 CBLB (1.00) CBLB
SCHEMBL30625503 0.79 CBLB (0.64) CBLBCBL
SCHEMBL31578397 0.78 CBLB (0.66) CBLBCBL
SCHEMBL31115348 0.78 CBLB (0.64) CBLBCBL

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
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
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