SCHEMBL30625577

SCHEMBL30625577

Cn1cnnc1C1(c2cccc(NC(=O)c3cc(CNC4CCCCC4)c4c(n3)C(C)(C)CC4)c2)CC(CC#N)C1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 19/20 0.53
▸ CBLC Q9ULV8 3/20 0.53
▸ ACKR3 P25106 1/20 0.32

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
SCHEMBL30540570 1.00 CBLB (0.53) CBLBCBLCACKR3
SCHEMBL30625633 1.00 CBLB (0.53) CBLBCBLCACKR3
SCHEMBL30625631 0.99 CBLB (0.53) CBLBCBLC
SCHEMBL30625428 0.94 CBLB (0.52) CBLBCBLC
SCHEMBL30625426 0.94 CBLB (0.52) CBLBCBLC
SCHEMBL31578360 0.93 CBLB (0.53) CBLBCBLC
SCHEMBL31578309 0.90 CBLB (0.55) CBLBCBLC
SCHEMBL31578164 0.90 CBLB (0.52) CBLBCBLC
SCHEMBL31578297 0.90 CBLB (0.52) CBLBCBLC
SCHEMBL30540470 0.90 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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