SCHEMBL30625559

SCHEMBL30625559

Cn1cnnc1C1(c2cccc(NC(=O)c3cc(CNC4CCCCCCC4)c4c(n3)C(C)(C)CN4)c2)CC(CC#N)C1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 18/20 0.53
▸ CBLC Q9ULV8 2/20 0.53
▸ ACKR3 P25106 2/20 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
SCHEMBL30625647 1.00 CBLB (0.53) CBLBCBLCACKR3
SCHEMBL30625474 1.00 CBLB (0.53) CBLBCBLCACKR3
SCHEMBL30625468 0.99 CBLB (0.54) CBLBCBLCACKR3
SCHEMBL30625556 0.98 CBLB (0.54) CBLBCBLC
SCHEMBL25357855 0.94 CBLB (0.51) CBLBCBLC
SCHEMBL30625632 0.94 CBLB (0.51) CBLBCBLC
SCHEMBL30625622 0.93 CBLB (0.50) CBLBCBLC
SCHEMBL25361321 0.93 CBLB (0.50) CBLBCBLC
SCHEMBL25364967 0.92 CBLB (0.54) CBLBCBLC
SCHEMBL30625498 0.92 CBLB (0.54) 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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