SCHEMBL30577690

SCHEMBL30577690

C[C@H]1CCCN(Cc2cc(C(=O)Nc3cccc(C4(c5nncn5C)CC(CC#N)C4)c3)nc3ccn(C)c23)C1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 17/20 0.66
▸ CBLC Q9ULV8 3/20 0.66
▸ TERT O14746 1/20 0.35
▸ PCSK9 Q8NBP7 1/20 0.34
▸ CBL P22681 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
SCHEMBL30540638 0.90 CBLB (0.78) CBLBCBLCTERTPCSK9CBL
SCHEMBL31578104 0.89 CBLB (0.58) CBLBCBLCTERTPCSK9CBL
SCHEMBL30540441 0.89 CBLB (0.67) CBLBCBLCTERTPCSK9CBL
SCHEMBL30625431 0.88 CBLB (0.63) CBLBCBLCTERT
SCHEMBL30625414 0.88 CBLB (0.63) CBLBCBLCTERT
SCHEMBL30625599 0.88 CBLB (0.63) CBLBCBLCTERT
SCHEMBL25363239 0.87 CBLB (0.61) CBLBCBLCTERT
SCHEMBL31115324 0.87 CBLB (0.61) CBLBCBLCTERTPCSK9
SCHEMBL30540549 0.87 CBLB (0.61) CBLBCBLCTERT
SCHEMBL31115410 0.86 CBLB (0.60) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023151641-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BEIGENE , LTD. (KY) 2023-08-17 — — WO disclosed
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