SCHEMBL23129088

SCHEMBL23129088

C[C@H]1CN(c2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3=O)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 19/20 0.59
▸ DDB1 Q16531 11/20 0.53
▸ ALDH1A1 P00352 1/20 0.45
▸ CHRM2 P08172 1/20 0.45
▸ OPRM1 P35372 1/20 0.45
▸ IKZF3 Q9UKT9 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ AR P10275 1/20 0.44
▸ HPGDS O60760 2/20 0.44

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
SCHEMBL22661306 0.89 CRBN (0.56) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL22661308 0.89 CRBN (0.56) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL30312870 0.89 CRBN (0.54) CRBNDDB1ARHPGDS
SCHEMBL26511843 0.88 CRBN (0.55) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL22661305 0.87 CRBN (0.54) CRBNDDB1ARHPGDS
SCHEMBL23129093 0.87 CRBN (0.54) CRBNDDB1ARHPGDS
SCHEMBL29629059 0.87 CRBN (0.67) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL22297514 0.87 CRBN (0.67) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL20046281 0.87 CRBN (0.67) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL28493713 0.84 CRBN (0.70) CRBNDDB1ALDH1A1CHRM2OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230135173-A1 NOVEL SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2023-05-04 — — US disclosed
US-20230135173-A1 NOVEL SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2023-05-04 — — US disclosed
US-11535606-B2 Substituted quinoline-8-carbonitrile derivatives with androgen receptor degradation activity and uses thereof ACCUTAR BIOTECHNOLOGY INC. (US) 2022-12-27 — — US disclosed
WO-2021061204-A1 NOVEL SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2021-04-01 — — WO disclosed
WO-2021061644-A1 NOVEL SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES WITH ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2021-04-01 — — WO disclosed
US-20210087171-A1 NOVEL SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES WITH ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2021-03-25 — — US disclosed
EP-3795570-A1 SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF Accutar Biotechnology Inc. (US) 2021-03-24 — — EP 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 (3 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-20210087171-A1 NOVEL SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES WITH ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF AR, NR5A1, ESRRA CRBN 392/4885DDB1 590/4885ALDH1A1 338/4885
US-11535606-B2 Substituted quinoline-8-carbonitrile derivatives with androgen receptor degradation activity and uses thereof AR, NR5A1, ESRRA CRBN 360/4885DDB1 897/4885ALDH1A1 290/4885
US-20230135173-A1 NOVEL SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF AR, NR5A1, ESRRA CRBN 409/4885DDB1 608/4885ALDH1A1 303/4885

“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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