SCHEMBL20046479

SCHEMBL20046479

CCN1CC(CN2CCN(C(C)C)CC2)C1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
DAO P14920 1/20 0.31
HTR2B P41595 1/20 0.31
CCR2 P41597 1/20 0.30
KCNH2 Q12809 1/20 0.30
MAOB P27338 2/20 0.30
KDM1A O60341 1/20 0.30

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
SCHEMBL22873408 0.86 KDM4E (0.36) KDM4EALDH1A1TDP1CCR2KCNH2
SCHEMBL20046475 0.86 KCNH2 (0.34) KDM4EALDH1A1TDP1DAOHTR2B
SCHEMBL24294565 0.83 ACHE (0.40) KDM4EALDH1A1TDP1KCNH2
SCHEMBL22564944 0.82 DAO (0.35) KDM4EALDH1A1TDP1DAOHTR2B
SCHEMBL10092699 0.79 CHRM5 (0.43) KDM4EALDH1A1TDP1DAOKCNH2
SCHEMBL24233079 0.79 ACHE (0.40) KDM4EALDH1A1TDP1CCR2KCNH2
SCHEMBL17482104 0.79 DAO (0.38) KDM4EALDH1A1TDP1DAOMAOB
SCHEMBL684100 0.79 DAO (0.38) KDM4EALDH1A1TDP1DAOMAOB
SCHEMBL6660826 0.79 DAO (0.38) KDM4EALDH1A1TDP1DAOMAOB
SCHEMBL21946657 0.78 DAO (0.35) KDM4EALDH1A1TDP1DAOMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210171470-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2021-06-10 US disclosed
US-20210040044-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR Arvinas, Inc. 2021-02-11 US disclosed
US-10844021-B2 Compounds and methods for the targeted degradation of androgen receptor ARVINAS OPERATIONS, INC. (US) 2020-11-24 US disclosed
US-20180099940-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2018-04-12 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-20210040044-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ADRM1, CRBN KDM4E 713/4885ALDH1A1 824/4885TDP1 2820/4885
US-20210171470-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ADRM1, CRBN KDM4E 713/4885ALDH1A1 824/4885TDP1 2820/4885
US-20180099940-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ADRM1, CRBN KDM4E 713/4885ALDH1A1 824/4885TDP1 2820/4885
US-10844021-B2 Compounds and methods for the targeted degradation of androgen receptor AR, ADRM1, CRBN KDM4E 713/4885ALDH1A1 824/4885TDP1 2820/4885

“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.