SCHEMBL24623920

SCHEMBL24623920

CC(C)(C)C(=O)COc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.78

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 18/20 0.78
▸ CRBN Q96SW2 18/20 0.78
▸ IKZF3 Q9UKT9 2/20 0.57
▸ TNF P01375 1/20 0.57
▸ IL1B P01584 1/20 0.57
▸ TBXA2R P21731 1/20 0.57
▸ IKZF1 Q13422 1/20 0.57
▸ STAT3 P40763 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.54
▸ CHRM2 P08172 1/20 0.54
▸ OPRM1 P35372 1/20 0.54
▸ CYP1A2 P05177 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54

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
SCHEMBL19481530 0.89 DDB1 (0.83) DDB1CRBNIKZF3TNFIL1B
SCHEMBL24746775 0.89 DDB1 (0.81) DDB1CRBNIKZF3TNFIL1B
SCHEMBL17839798 0.89 DDB1 (0.81) DDB1CRBNIKZF3TNFIL1B
SCHEMBL29360230 0.88 CRBN (1.00) DDB1CRBNIKZF3TNFIL1B
SCHEMBL14085581 0.88 CRBN (1.00) DDB1CRBNIKZF3TNFIL1B
SCHEMBL20014292 0.88 CRBN (0.76) DDB1CRBNIKZF3TNFIL1B
SCHEMBL14085574 0.87 CRBN (1.00) DDB1CRBNIKZF3TNFIL1B
SCHEMBL18379320 0.87 CRBN (0.83) DDB1CRBNIKZF3TNFIL1B
SCHEMBL17884453 0.87 CRBN (0.83) DDB1CRBNIKZF3TNFIL1B
SCHEMBL18379436 0.87 CRBN (0.83) DDB1CRBNIKZF3TNFIL1B

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-20220218722-A1 COUMARIN-MODIFIED ANDROGENS FOR THE TREATMENT OF PROSTATE CANCER UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2022-07-14 — — 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-20220218722-A1 COUMARIN-MODIFIED ANDROGENS FOR THE TREATMENT OF PROSTATE CANCER AR, SHBG, NCOA1 DDB1 275/4885CRBN 733/4885IKZF3 2608/4885

“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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