SCHEMBL22507992

SCHEMBL22507992

NCCCCCCNC(=O)COc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 8/20 0.56
▸ BRD4 O60885 5/20 0.56
▸ HDAC1 Q13547 5/20 0.51
▸ HDAC6 Q9UBN7 5/20 0.51
▸ HDAC3 O15379 2/20 0.51
▸ HDAC2 Q92769 2/20 0.51
▸ STAT3 P40763 2/20 0.51
▸ HDAC4 P56524 1/20 0.51
▸ NCOR2 Q9Y618 1/20 0.51
▸ DDB1 Q16531 5/20 0.46
▸ GSK3B P49841 3/20 0.45
▸ PIP4K2C Q8TBX8 1/20 0.44
▸ TRIM24 O15164 2/20 0.42
▸ FOXM1 Q08050 1/20 0.42
▸ TRIM33 Q9UPN9 1/20 0.42

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
SCHEMBL23015941 1.00 CRBN (0.56) CRBNBRD4HDAC1HDAC6HDAC3
SCHEMBL19068590 0.99 CRBN (0.56) CRBNBRD4HDAC1HDAC6HDAC3
SCHEMBL19387868 0.93 CRBN (0.53) CRBNBRD4HDAC1HDAC6HDAC3
SCHEMBL20013947 0.93 CRBN (0.52) CRBNBRD4HDAC1HDAC6HDAC3
SCHEMBL18492637 0.87 CRBN (0.51) CRBNBRD4HDAC1HDAC6HDAC3
SCHEMBL20153975 0.87 CRBN (0.54) CRBNBRD4HDAC1HDAC6HDAC3
SCHEMBL24937918 0.86 STAT3 (0.51) CRBNBRD4HDAC1HDAC6HDAC3
SCHEMBL20154048 0.85 CRBN (0.52) CRBNBRD4HDAC1HDAC6HDAC3
SCHEMBL19387899 0.84 CRBN (0.54) CRBNBRD4HDAC1HDAC6HDAC3
SCHEMBL24142023 0.83 STAT3 (0.70) CRBNBRD4HDAC1HDAC6HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11059801-B2 Methods to induce targeted protein degradation through bifunctional molecules DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-07-13 — — US disclosed
US-20200317635-A1 METHODS TO INDUCE TARGETED PROTEIN DEGRADATION THROUGH BIFUNCTIONAL MOLECULES DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-10-08 — — 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 (2 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-11059801-B2 Methods to induce targeted protein degradation through bifunctional molecules CRBN, XIAP, MDM2 CRBN 1/4885BRD4 1005/4885HDAC1 2203/4885
US-20200317635-A1 METHODS TO INDUCE TARGETED PROTEIN DEGRADATION THROUGH BIFUNCTIONAL MOLECULES CRBN, MDM2, MYCBP CRBN 1/4885BRD4 687/4885HDAC1 2291/4885

“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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