SCHEMBL22021679

SCHEMBL22021679

CN(CCC(C)(C)C)C(=O)CCCC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 2/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ ACHE P22303 8/20 0.33
▸ BCHE P06276 7/20 0.33
▸ LMNA P02545 1/20 0.32
▸ CHRM2 P08172 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ KDM4A O75164 5/20 0.31
▸ KDM4C Q9H3R0 5/20 0.31
▸ KDM5A P29375 1/20 0.31
▸ KDM7A Q6ZMT4 1/20 0.31
▸ PHF8 Q9UPP1 1/20 0.31
▸ KDM2A Q9Y2K7 1/20 0.31
▸ NAMPT P43490 1/20 0.31

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
SCHEMBL22021685 0.92 EPHX2 (0.41) EPHX2ACHEBCHECHRM2CHRM1
SCHEMBL22021680 0.92 EPHX2 (0.41) EPHX2ACHEBCHECHRM2CHRM1
SCHEMBL22021658 0.92 EPHX2 (0.41) EPHX2ACHEBCHECHRM2CHRM1
SCHEMBL22021683 0.87 NAMPT (0.32) EPHX2CNR1NAMPT
SCHEMBL22021691 0.86 EPHX2 (0.50) EPHX2CNR1ALDH1A1KDM4CKDM5A
SCHEMBL21456131 0.85 CYP4F2 (0.42) EPHX2CNR1ACHEBCHECHRM2
SCHEMBL22166531 0.85 EPHX2 (0.53) EPHX2CNR1ALDH1A1KDM4CKDM5A
SCHEMBL22166535 0.85 EPHX2 (0.53) EPHX2CNR1ALDH1A1KDM4CKDM5A
SCHEMBL22021900 0.84 EPHX2 (0.36) EPHX2ACHEBCHECHRM2CHRM1
SCHEMBL23639725 0.84 — —

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-11642342-B2 Combinations of estrogen receptor degraders and cyclin-dependent kinase inhibitors for treating cancer Accutar Biotechnology (US) 2023-05-09 — — US disclosed
US-11642342-B2 Combinations of estrogen receptor degraders and cyclin-dependent kinase inhibitors for treating cancer Accutar Biotechnology (US) 2023-05-09 — — US disclosed
US-20220220124-A1 NOVEL COMPOUNDS HAVING BET, ESTROGEN RECEPTOR, AND ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2022-07-14 — — US disclosed
US-11117885-B2 Compounds having estrogen receptor alpha degradation activity and uses thereof ACCUTAR BIOTECHNOLOGY INC. (US) 2021-09-14 — — US disclosed
US-20200299264-A1 COMPOUNDS HAVING ESTROGEN RECEPTOR ALPHA DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2020-09-24 — — US disclosed
US-10696659-B2 Compounds having estrogen receptor alpha degradation activity and uses thereof ACCUTAR BIOTECHNOLOGY INC. (US) 2020-06-30 — — US disclosed
US-20200157078-A1 NOVEL COMPOUNDS HAVING ESTROGEN RECEPTOR ALPHA DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2020-05-21 — — 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-11117885-B2 Compounds having estrogen receptor alpha degradation activity and uses thereof ESR2, ESRRG, ESR1 EPHX2 896/4885CNR1 645/4885ALDH1A1 430/4885
US-20220220124-A1 NOVEL COMPOUNDS HAVING BET, ESTROGEN RECEPTOR, AND ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF AR, ESRRA, ESR1 EPHX2 2088/4885CNR1 151/4885ALDH1A1 568/4885
US-20200157078-A1 NOVEL COMPOUNDS HAVING ESTROGEN RECEPTOR ALPHA DEGRADATION ACTIVITY AND USES THEREOF ESR2, ESRRG, ESR1 EPHX2 951/4885CNR1 495/4885ALDH1A1 350/4885
US-20200299264-A1 COMPOUNDS HAVING ESTROGEN RECEPTOR ALPHA DEGRADATION ACTIVITY AND USES THEREOF ESR2, ESRRG, ESR1 EPHX2 896/4885CNR1 645/4885ALDH1A1 430/4885
US-11642342-B2 Combinations of estrogen receptor degraders and cyclin-dependent kinase inhibitors for treating cancer CDK3, CDK4, CDK1 EPHX2 1763/4885CNR1 844/4885ALDH1A1 4096/4885
US-10696659-B2 Compounds having estrogen receptor alpha degradation activity and uses thereof ESR2, ESRRG, ESR1 EPHX2 896/4885CNR1 645/4885ALDH1A1 430/4885

“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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