SCHEMBL25691056

SCHEMBL25691056

O=C1CCC(N2C(=O)c3ccc(N4CCN(CC5CCN(c6cc(F)c([N+](=O)[O-])cc6F)CC5)CC4)cc3C2=O)C(=O)N1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 14/20 0.54
▸ DDB1 Q16531 5/20 0.51
▸ AR P10275 5/20 0.48
▸ PLK4 O00444 2/20 0.47
▸ CDK9 P50750 1/20 0.45
▸ ALK Q9UM73 1/20 0.44
▸ IRAK1 P51617 1/20 0.43
▸ IRAK4 Q9NWZ3 1/20 0.43
▸ IRAK3 Q9Y616 1/20 0.43
▸ BTK Q06187 1/20 0.43
▸ RAF1 P04049 1/20 0.43
▸ ESR1 P03372 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
SCHEMBL25691424 0.93 CRBN (0.45) CRBNDDB1ARPLK4CDK9
SCHEMBL31306505 0.88 CRBN (0.53) CRBNDDB1ARPLK4CDK9
SCHEMBL23134596 0.88 CRBN (0.58) CRBNDDB1ARPLK4CDK9
SCHEMBL29822222 0.87 CRBN (0.54) CRBNDDB1ESR1
SCHEMBL23117892 0.87 CRBN (0.54) CRBNDDB1ESR1
SCHEMBL23117896 0.87 CRBN (0.54) CRBNDDB1ESR1
SCHEMBL31306538 0.86 CRBN (0.58) CRBNDDB1ARPLK4CDK9
SCHEMBL28795318 0.85 CDK9 (0.51) CRBNDDB1ARPLK4CDK9
SCHEMBL28795171 0.85 CDK9 (0.51) CRBNDDB1ARPLK4CDK9
SCHEMBL31458460 0.85 CDK9 (0.51) CRBNDDB1ARPLK4CDK9

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-20230150973-A1 NOVEL UREAS HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2023-05-18 — — 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-20230150973-A1 NOVEL UREAS HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF AR, UTS2R, ESRRA CRBN 1041/4885DDB1 1112/4885AR 1/4885

“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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