SCHEMBL21026161

SCHEMBL21026161

CCOC(=O)C1CCC(Nc2ccc(CN3CCCCC3)cc2N)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.53
ALDH1A1 P00352 6/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
ALOX15 P16050 1/20 0.53
HRH3 Q9Y5N1 1/20 0.52
MET P08581 1/20 0.49
ALK Q9UM73 1/20 0.49
MAPT P10636 1/20 0.48
CCR8 P51685 1/20 0.47
KMT2A Q03164 1/20 0.46
ATM Q13315 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL20985376 0.85 HRH3 (0.46) ALDH1A1ALOX15HRH3ALK
SCHEMBL20985378 0.85 HRH3 (0.46) ALDH1A1ALOX15HRH3ALK
SCHEMBL21025998 0.85 ALDH1A1 (0.49) KDM4EALDH1A1SMN1; SMN2HRH3MET
SCHEMBL29313717 0.85 ALDH1A1 (0.49) KDM4EALDH1A1SMN1; SMN2HRH3MET
SCHEMBL5448454 0.83 HRH3 (0.60) KDM4EALDH1A1SMN1; SMN2HRH3MET
SCHEMBL5448451 0.83 HRH3 (0.60) KDM4EALDH1A1SMN1; SMN2HRH3MET
SCHEMBL5418450 0.82 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2HRH3MAPT
SCHEMBL5434398 0.82 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2HRH3MAPT
SCHEMBL5418453 0.82 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2HRH3MAPT
SCHEMBL29124557 0.80 HRH3 (0.50) KDM4EALDH1A1SMN1; SMN2ALOX15HRH3

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 6 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-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-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-20220331297-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 POLYPEPTIDES ARVINAS OPERATIONS, INC. 2022-10-20 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 (4 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 KDM4E 1071/4885ALDH1A1 2896/4885SMN1; SMN2 1794/4885
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 KDM4E 1450/4885ALDH1A1 2211/4885SMN1; SMN2 1811/4885
US-11065231-B2 Compounds and methods for the targeted degradation of interleukin-1 receptor- associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 KDM4E 1071/4885ALDH1A1 2896/4885SMN1; SMN2 1794/4885
US-20220331297-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 POLYPEPTIDES IRAK1, IRAK4, IRAK2 KDM4E 1071/4885ALDH1A1 2896/4885SMN1; SMN2 1794/4885

“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.