SCHEMBL21026277

SCHEMBL21026277

CCOC(=O)[C@H]1CC[C@@H](n2c(N)nc3cc(CN4CCCCC4)ccc32)CC1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 6/20 0.60
▸ MET P08581 1/20 0.60
▸ KDM4E B2RXH2 7/20 0.49
▸ ALDH1A1 P00352 5/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ HRH3 Q9Y5N1 1/20 0.48
▸ KMT2A Q03164 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ CCR8 P51685 1/20 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
SCHEMBL21026017 1.00 ALK (0.60) ALKMETKDM4EALDH1A1SMN1; SMN2
SCHEMBL21025771 0.86 PRKACA (0.49) ALKMETKDM4EALDH1A1SMN1; SMN2
SCHEMBL29937671 0.86 PRKACA (0.49) ALKMETKDM4EALDH1A1SMN1; SMN2
SCHEMBL20985345 0.86 SPR (0.55) ALKMETHRH3
SCHEMBL20985344 0.86 SPR (0.55) ALKMETHRH3
SCHEMBL21025907 0.86 PRKACA (0.49) ALKMETKDM4EALDH1A1SMN1; SMN2
SCHEMBL1926108 0.82 ALDH1A1 (0.47) ALKMETKDM4EALDH1A1SMN1; SMN2
SCHEMBL1924797 0.81 ALDH1A1 (0.47) KDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL13500558 0.81 ALDH1A1 (0.47) KDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL1924796 0.81 ALDH1A1 (0.47) KDM4EALDH1A1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2024-07-16 — — US disclosed
US-11065231-B2 Compounds and methods for the targeted degradation of interleukin-1 receptor- associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2021-07-20 — — US disclosed
US-20190151295-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 POLYPEPTIDES ARVINAS OPERATIONS, INC. 2019-05-23 — — 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 (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-20190151295-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 POLYPEPTIDES IRAK1, IRAK4, IRAK2 ALK 754/4885MET 205/4885KDM4E 1071/4885
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 ALK 746/4885MET 234/4885KDM4E 1450/4885
US-11065231-B2 Compounds and methods for the targeted degradation of interleukin-1 receptor- associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 ALK 754/4885MET 205/4885KDM4E 1071/4885

“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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