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SCHEMBL24420866

SCHEMBL24420866

O=C1CCC(N2C(=O)c3cc(N4CCC(CN5CCC(S(=O)(=O)N6CCN7c8cc(-c9ccccc9O)nnc8NC[C@H]7C6)CC5)CC4)ccc3C2O)C(=O)N1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 9/20 0.38
▸ ESR1 P03372 1/20 0.38
▸ AR P10275 1/20 0.34
▸ EGFR P00533 7/20 0.33
▸ PLK4 O00444 2/20 0.33
▸ CDK9 P50750 1/20 0.33
▸ BTK Q06187 3/20 0.32
▸ ITK Q08881 1/20 0.32
▸ IRAK1 P51617 1/20 0.31
▸ IRAK4 Q9NWZ3 1/20 0.31
▸ IRAK3 Q9Y616 1/20 0.31
▸ DDB1 Q16531 1/20 0.31

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
SCHEMBL30297836 0.91 CRBN (0.42) CRBNESR1AREGFRPLK4
SCHEMBL24421155 0.91 CRBN (0.42) CRBNESR1AREGFRPLK4
SCHEMBL24421474 0.90 CRBN (0.39) CRBNESR1AREGFRPLK4
SCHEMBL24421451 0.87 CRBN (0.38) CRBNESR1AREGFRPLK4
SCHEMBL24421179 0.87 CRBN (0.40) CRBNESR1AREGFRCDK9
SCHEMBL24421568 0.86 CRBN (0.37) CRBNESR1AREGFRPLK4
SCHEMBL24420813 0.83 CRBN (0.46) CRBNESR1AREGFRPLK4
SCHEMBL30297830 0.83 CRBN (0.46) CRBNESR1AREGFRPLK4
SCHEMBL24421103 0.83 CRBN (0.33) CRBNESR1EGFRIRAK1IRAK4
SCHEMBL24421025 0.81 CRBN (0.47) CRBNESR1AREGFRPLK4

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-2022099117-A1 BRM TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE PRELUDE THERAPEUTICS INCORPORATED (US) 2022-05-12 — — WO disclosed
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