SCHEMBL29547625

SCHEMBL29547625

O=C1CCC(N2C(=O)c3ccc(N4CCN(CCC5CCN(c6ncc(Br)cc6F)CC5)CC4)cc3C2=O)C(=O)N1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 11/20 0.54
▸ DDB1 Q16531 2/20 0.48
▸ CCNC P24863 1/20 0.47
▸ CDK8 P49336 1/20 0.47
▸ IRAK1 P51617 1/20 0.47
▸ NTRK3 Q16288 1/20 0.47
▸ HASPIN Q8TF76 1/20 0.47
▸ CDK19 Q9BWU1 1/20 0.47
▸ IRAK4 Q9NWZ3 1/20 0.47
▸ IRAK3 Q9Y616 1/20 0.47
▸ RAF1 P04049 2/20 0.46
▸ IL2 P60568 1/20 0.46
▸ ITK Q08881 1/20 0.46
▸ AR P10275 1/20 0.45
▸ EGFR P00533 4/20 0.45
▸ HPGDS O60760 2/20 0.45
▸ ESR1 P03372 2/20 0.45
▸ BTK Q06187 2/20 0.44
▸ PLK4 O00444 1/20 0.43
▸ ERBB2 P04626 1/20 0.43

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
SCHEMBL27098853 1.00 CRBN (0.54) CRBNDDB1CCNCCDK8IRAK1
SCHEMBL27098721 0.91 CRBN (0.53) CRBNDDB1CCNCCDK8IRAK1
SCHEMBL29547410 0.91 CRBN (0.53) CRBNDDB1CCNCCDK8IRAK1
SCHEMBL27098772 0.90 CRBN (0.52) CRBNDDB1CCNCCDK8IRAK1
SCHEMBL27098787 0.89 CRBN (0.58) CRBNDDB1CCNCCDK8IRAK1
SCHEMBL27098821 0.88 CRBN (0.56) CRBNDDB1CCNCCDK8IRAK1
SCHEMBL27098779 0.88 CRBN (0.53) CRBNDDB1CCNCCDK8IRAK1
SCHEMBL27098727 0.84 CRBN (0.54) CRBNDDB1IRAK1IRAK4IRAK3
SCHEMBL23129006 0.84 CRBN (0.51) CRBNCCNCCDK8IRAK1NTRK3
SCHEMBL27098768 0.83 CRBN (0.52) CRBNDDB1CCNCCDK8IRAK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119954801-A TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2025-05-09 — — CN disclosed
CN-114867727-B TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2025-02-21 — — CN disclosed
CN-114867727-A TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2022-08-05 — — CN disclosed
EP-3999182-A1 TAU-PROTEIN TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE Arvinas Operations, Inc. (US) 2022-05-25 — — EP disclosed
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