SCHEMBL29337546

SCHEMBL29337546

O=C1CCC(N2C(=O)c3ccc(OCCOCCOCCOCCS(=O)(=O)N4CCN(C56CCC5CC6)CC4)cc3C2=O)C(=O)N1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.46
▸ LRRK2 Q5S007 1/20 0.45
▸ IRAK4 Q9NWZ3 1/20 0.44
▸ CRBN Q96SW2 12/20 0.44
▸ DDB1 Q16531 10/20 0.44
▸ ALDH1A1 P00352 1/20 0.41
▸ CHRM2 P08172 1/20 0.41
▸ OPRM1 P35372 1/20 0.41
▸ IKZF3 Q9UKT9 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ EGFR P00533 1/20 0.41

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
SCHEMBL29337565 0.85 IRAK4 (0.52) MAPTLRRK2IRAK4CRBNDDB1
SCHEMBL21026283 0.85 IRAK4 (0.52) MAPTLRRK2IRAK4CRBNDDB1
SCHEMBL30817904 0.81 CRBN (0.53) MAPTLRRK2CRBNDDB1ALDH1A1
SCHEMBL29336480 0.78 CRBN (0.58) MAPTLRRK2IRAK4CRBNDDB1
SCHEMBL28719101 0.78 CRBN (0.53) MAPTLRRK2CRBNDDB1ALDH1A1
SCHEMBL23267590 0.77 CRBN (0.60) MAPTLRRK2IRAK4CRBNDDB1
SCHEMBL20985423 0.77 CRBN (0.60) MAPTLRRK2CRBNDDB1ALDH1A1
SCHEMBL20120293 0.77 CRBN (0.60) MAPTLRRK2CRBNDDB1ALDH1A1
SCHEMBL22276613 0.77 CRBN (0.60) MAPTLRRK2IRAK4CRBNDDB1
SCHEMBL20294594 0.77 CRBN (0.60) MAPTLRRK2IRAK4CRBNDDB1

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
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2024-07-16 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 MAPT 1544/4885LRRK2 235/4885IRAK4 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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