SCHEMBL29312172

SCHEMBL29312172

C[C@@]1(N2CCc3ccccc3C2=O)CCC(=O)NC1=O

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 4/20 0.50
▸ DDB1 Q16531 3/20 0.50
▸ HTR2C P28335 5/20 0.44
▸ HTR2B P41595 5/20 0.44
▸ HTR2A P28223 4/20 0.44
▸ SIGMAR1 Q99720 2/20 0.40
▸ SRD5A1 P18405 1/20 0.38
▸ PARP1 P09874 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.37

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
SCHEMBL29312174 1.00 CRBN (0.50) CRBNDDB1HTR2CHTR2BHTR2A
SCHEMBL845542 0.88 CRBN (0.51) CRBNDDB1HTR2CHTR2BHTR2A
SCHEMBL20128632 0.88 CRBN (0.51) CRBNDDB1HTR2CHTR2BHTR2A
SCHEMBL20128631 0.88 CRBN (0.51) CRBNDDB1HTR2CHTR2BHTR2A
SCHEMBL21391303 0.78 CRBN (0.60) CRBNDDB1ALDH1A1
SCHEMBL21391302 0.78 CRBN (0.60) CRBNDDB1ALDH1A1
SCHEMBL17552856 0.77 CRBN (0.72) CRBNDDB1ALDH1A1
SCHEMBL5515897 0.77 CRBN (0.72) CRBNDDB1ALDH1A1
SCHEMBL17169674 0.77 CRBN (0.72) CRBNDDB1ALDH1A1
SCHEMBL30184407 0.77 CRBN (0.72) CRBNDDB1ALDH1A1

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 CRBN 5/4885DDB1 594/4885HTR2C 3949/4885

“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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