SCHEMBL22532036

SCHEMBL22532036

O=C1CCC(N2C(=O)c3cccc4cc(OCC(=O)Oc5c(F)c(F)c(F)c(F)c5F)cc(c34)C2=O)C(=O)N1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 19/20 0.53
▸ DDB1 Q16531 18/20 0.53
▸ IKZF3 Q9UKT9 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ CHRM2 P08172 1/20 0.46
▸ OPRM1 P35372 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ TNF P01375 1/20 0.43
▸ IL1B P01584 1/20 0.43
▸ TBXA2R P21731 1/20 0.43
▸ IKZF1 Q13422 1/20 0.43

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
SCHEMBL29549308 1.00 CRBN (0.53) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL22532028 0.87 CRBN (0.66) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29549346 0.87 CRBN (0.66) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL22531990 0.86 DDB1 (0.54) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29388131 0.86 DDB1 (0.54) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL24745329 0.85 CRBN (0.56) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL22532011 0.85 FOXM1 (0.36) CRBNDDB1ALDH1A1CYP1A2
SCHEMBL29549154 0.85 FOXM1 (0.36) CRBNDDB1ALDH1A1CYP1A2
SCHEMBL22845547 0.83 CRBN (0.63) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL22532018 0.82 CRBN (0.78) CRBNDDB1IKZF3ALDH1A1CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220177466-A1 DEGRADERS OF KELCH-LIKE ECH-ASSOCIATED PROTEIN 1 (KEAP1) DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-06-09 — — US disclosed
US-20220177466-A1 DEGRADERS OF KELCH-LIKE ECH-ASSOCIATED PROTEIN 1 (KEAP1) DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-06-09 — — US disclosed
EP-3953337-A1 DEGRADERS OF KELCH-LIKE ECH-ASSOCIATED PROTEIN 1 (KEAP1) Dana-Farber Cancer Institute, Inc. (US) 2022-02-16 — — EP disclosed
WO-2020210229-A1 DEGRADERS OF KELCH-LIKE ECH-ASSOCIATED PROTEIN 1 (KEAP1) DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-10-15 — — WO 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-20220177466-A1 DEGRADERS OF KELCH-LIKE ECH-ASSOCIATED PROTEIN 1 (KEAP1) KEAP1, NFE2L2, GSTK1 CRBN 250/4885DDB1 106/4885IKZF3 595/4885

“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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