SCHEMBL22661318

SCHEMBL22661318

CC(C)(C)OC(=O)c1cnc(N2CCC(CN3CCN(c4ccc5c(c4)C(=O)N(C4CCC(=O)NC4=O)C5=O)CC3)CC2)nc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 12/20 0.55
▸ AR P10275 4/20 0.55
▸ DDB1 Q16531 1/20 0.49
▸ HPGDS O60760 1/20 0.48
▸ BTK Q06187 3/20 0.48
▸ IRAK1 P51617 1/20 0.48
▸ IRAK4 Q9NWZ3 1/20 0.48
▸ IRAK3 Q9Y616 1/20 0.48
▸ ESR1 P03372 1/20 0.47
▸ CDK9 P50750 1/20 0.47
▸ EGFR P00533 4/20 0.47
▸ RAF1 P04049 2/20 0.47
▸ ITK Q08881 1/20 0.46

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
SCHEMBL22645400 0.92 CRBN (0.54) CRBNARDDB1HPGDSBTK
SCHEMBL21477174 0.91 CRBN (0.58) CRBNARDDB1HPGDSBTK
SCHEMBL22661317 0.89 CRBN (0.57) CRBNARDDB1HPGDSBTK
SCHEMBL29596415 0.88 CRBN (0.56) CRBNARDDB1HPGDSBTK
SCHEMBL22661324 0.86 CRBN (0.53) CRBNARDDB1BTKIRAK1
SCHEMBL20046435 0.86 CRBN (0.54) CRBNARDDB1HPGDSBTK
SCHEMBL29058485 0.86 CRBN (0.59) CRBNARDDB1HPGDSBTK
SCHEMBL30488998 0.86 CRBN (0.54) CRBNARDDB1HPGDSBTK
SCHEMBL29058484 0.86 CRBN (0.54) CRBNARDDB1HPGDSBTK
SCHEMBL20234891 0.85 CRBN (0.58) CRBNARDDB1HPGDSBTK

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
US-11312702-B2 Substituted quinoline-8-carbonitrile derivatives having androgen receptor degradation activity and uses thereof ACCUTAR BIOTECHNOLOGY INC. (US) 2022-04-26 — — US disclosed
US-20210087169-A1 NOVEL SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2021-03-25 — — US 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
US-10836749-B1 Substituted quinoline-8-carbonitrile derivatives having androgen receptor degradation activity and uses thereof ACCUTAR BIOTECHNOLOGY INC. (US) 2020-11-17 — — 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 (6 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-20210087169-A1 NOVEL SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF AR, NR5A1, ESRRA CRBN 409/4885AR 1/4885DDB1 608/4885
US-20210087171-A1 NOVEL SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES WITH ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF AR, NR5A1, ESRRA CRBN 392/4885AR 1/4885DDB1 590/4885
US-11535606-B2 Substituted quinoline-8-carbonitrile derivatives with androgen receptor degradation activity and uses thereof AR, NR5A1, ESRRA CRBN 360/4885AR 1/4885DDB1 897/4885
US-20230135173-A1 NOVEL SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF AR, NR5A1, ESRRA CRBN 409/4885AR 1/4885DDB1 608/4885
US-11312702-B2 Substituted quinoline-8-carbonitrile derivatives having androgen receptor degradation activity and uses thereof AR, NR5A1, ESRRA CRBN 357/4885AR 1/4885DDB1 922/4885
US-10836749-B1 Substituted quinoline-8-carbonitrile derivatives having androgen receptor degradation activity and uses thereof AR, NR5A1, ESRRA CRBN 357/4885AR 1/4885DDB1 922/4885

“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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