SCHEMBL29547197

SCHEMBL29547197

O=C1CCC(N2C(=O)c3ccc(N4CCN(CCC5CCN(C(=O)OCc6ccccc6)CC5)CC4)cc3C2=O)C(=O)N1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 13/20 0.54
▸ CCNC P24863 1/20 0.50
▸ CDK8 P49336 1/20 0.50
▸ IRAK1 P51617 1/20 0.50
▸ NTRK3 Q16288 1/20 0.50
▸ HASPIN Q8TF76 1/20 0.50
▸ CDK19 Q9BWU1 1/20 0.50
▸ IRAK4 Q9NWZ3 1/20 0.50
▸ IRAK3 Q9Y616 1/20 0.50
▸ DDB1 Q16531 4/20 0.48
▸ HPGDS O60760 2/20 0.48
▸ RAF1 P04049 2/20 0.47
▸ ITK Q08881 2/20 0.46
▸ IL2 P60568 1/20 0.46
▸ IKZF3 Q9UKT9 1/20 0.46
▸ BTK Q06187 1/20 0.45
▸ AR P10275 1/20 0.45
▸ TMEM97 Q5BJF2 5/20 0.44
▸ SIGMAR1 Q99720 5/20 0.44

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
SCHEMBL27098632 1.00 CRBN (0.54) CRBNCCNCCDK8IRAK1NTRK3
SCHEMBL22291366 0.97 CRBN (0.54) CRBNCCNCCDK8IRAK1NTRK3
SCHEMBL31043971 0.89 CRBN (0.56) CRBNIRAK1IRAK4IRAK3DDB1
SCHEMBL29927356 0.88 CRBN (0.57) CRBNDDB1HPGDSIKZF3
SCHEMBL29132159 0.88 CRBN (0.57) CRBNDDB1HPGDSIKZF3
SCHEMBL29927342 0.87 CRBN (0.55) CRBNDDB1HPGDSIKZF3TMEM97
SCHEMBL24501945 0.87 CRBN (0.57) CRBNCCNCCDK8IRAK1NTRK3
SCHEMBL22291403 0.87 CRBN (0.57) CRBNCCNCCDK8IRAK1NTRK3
SCHEMBL29648407 0.87 CRBN (0.57) CRBNCCNCCDK8IRAK1NTRK3
SCHEMBL31620804 0.87 CRBN (0.57) CRBNCCNCCDK8IRAK1NTRK3

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
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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