SCHEMBL30625498

SCHEMBL30625498

CNCc1cc(C(=O)Nc2cccc(C3(c4nncn4C)CC(CC#N)C3)c2)nc2c1NCC2(C)C

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 19/20 0.54
▸ CBLC Q9ULV8 2/20 0.54
▸ BACE1 P56817 1/20 0.33

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
SCHEMBL25364967 1.00 CBLB (0.54) CBLBCBLCBACE1
SCHEMBL30625447 0.94 CBLB (0.52) CBLBCBLCBACE1
SCHEMBL30625649 0.94 CBLB (0.56) CBLBCBLC
SCHEMBL25359963 0.94 CBLB (0.52) CBLBCBLC
SCHEMBL30625570 0.93 CBLB (0.54) CBLBCBLCBACE1
SCHEMBL30625660 0.93 CBLB (0.51) CBLBCBLCBACE1
SCHEMBL25360586 0.93 CBLB (0.51) CBLBCBLC
SCHEMBL25349534 0.92 CBLB (0.54) CBLBCBLC
SCHEMBL31115318 0.92 CBLB (0.54) CBLBCBLC
SCHEMBL31115372 0.92 CBLB (0.52) CBLBCBLC

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-2023151642-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BEIGENE , LTD. (KY) 2023-08-17 — — WO disclosed
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