SCHEMBL29330445

SCHEMBL29330445

C=C1CCC(N2C(=O)c3cc(F)c(N4CCN(C(=O)OC(C)(C)C)CC4)cc3C2=O)C(=O)N1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 11/20 0.57
DDB1 Q16531 8/20 0.43
BACE1 P56817 3/20 0.39
PDK2 Q15119 1/20 0.38
THRB P10828 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
TP53 P04637 1/20 0.37
SMARCA2 P51531 1/20 0.36
SMARCA4 P51532 1/20 0.36
PBRM1 Q86U86 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL31605528 0.91 CRBN (0.70) CRBNDDB1
SCHEMBL20046181 0.91 CRBN (0.70) CRBNDDB1
SCHEMBL29547640 0.91 CRBN (0.70) CRBNDDB1
SCHEMBL31589236 0.91 CRBN (0.70) CRBNDDB1
SCHEMBL31605512 0.91 CRBN (0.70) CRBNDDB1
SCHEMBL31589896 0.91 CRBN (0.70) CRBNDDB1
SCHEMBL21982902 0.85 CRBN (0.54) CRBNDDB1BACE1PDK2MAPT
SCHEMBL31236676 0.85 CRBN (0.64) CRBNDDB1
SCHEMBL31620797 0.83 CRBN (0.60) CRBNDDB1
SCHEMBL31491162 0.83 CRBN (0.60) CRBNDDB1

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-12043612-B2 Methods of manufacturing a bifunctional compound, ultrapure forms of the bifunctional compound, and dosage forms comprising the same ARVINAS OPERATIONS, INC. (US) 2024-07-23 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-12043612-B2 Methods of manufacturing a bifunctional compound, ultrapure forms of the bifunctional compound, and dosage forms comprising the same PAICS, UGT1A1, PBRM1 CRBN 1606/4885DDB1 2095/4885BACE1 2330/4885

“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.