SCHEMBL20076216

SCHEMBL20076216

N#Cc1ccc(N2CC[C@H](O)C2)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.60
KDM4E B2RXH2 1/20 0.50
TP53 P04637 1/20 0.50
HRH3 Q9Y5N1 10/20 0.47
HRH2 P25021 4/20 0.47
HRH1 P35367 4/20 0.47
NOTUM Q6P988 1/20 0.43
CHRNA10 Q9GZZ6 1/20 0.43
CHRNA9 Q9UGM1 1/20 0.43
USP5 P45974 1/20 0.41
USP14 P54578 1/20 0.41
USP7 Q93009 1/20 0.41
DPP4 P27487 1/20 0.41
CHEK1 O14757 1/20 0.40
KCNH2 Q12809 1/20 0.40
WDR91 A4D1P6 1/20 0.40

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
SCHEMBL320725 1.00 AR (0.60) ARKDM4ETP53HRH3HRH2
SCHEMBL10277569 1.00 AR (0.60) ARKDM4ETP53HRH3HRH2
SCHEMBL14637983 0.90 AR (0.50) ARKDM4ETP53HRH3HRH2
SCHEMBL2455962 0.89 KDM4E (0.58) ARKDM4ETP53HRH3HRH2
SCHEMBL7374751 0.85 KDM4E (0.52) ARKDM4ETP53HRH3HRH2
SCHEMBL9943882 0.83 KDM4E (0.51) ARKDM4ETP53HRH3HRH2
SCHEMBL3602267 0.81 NOTUM (0.67) ARNOTUM
SCHEMBL7491396 0.81 NOTUM (0.67) ARNOTUM
SCHEMBL14741020 0.81 KDM4E (0.56) ARKDM4ETP53HRH3NOTUM
SCHEMBL16567891 0.81 KDM4E (0.56) ARKDM4ETP53HRH3NOTUM

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-20230331681-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2023-10-19 US disclosed
EP-3660004-B1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS INC (US) 2023-02-22 EP disclosed
US-11236051-B2 Compounds and methods for the targeted degradation of androgen receptor ARVINAS OPERATIONS, INC. (US) 2022-02-01 US disclosed
US-20210009528-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR Arvinas, Inc. 2021-01-14 US disclosed
US-10844021-B2 Compounds and methods for the targeted degradation of androgen receptor ARVINAS OPERATIONS, INC. (US) 2020-11-24 US disclosed
EP-3660004-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR Arvinas Operations, Inc. (US) 2020-06-03 EP disclosed
WO-2018071606-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR Arvinas, Inc. (US) 2018-04-19 WO 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-20230331681-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ADRM1, CRBN AR 1/4885KDM4E 706/4885TP53 219/4885
US-20210009528-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ADRM1, CRBN AR 1/4885KDM4E 706/4885TP53 219/4885
US-10844021-B2 Compounds and methods for the targeted degradation of androgen receptor AR, ADRM1, CRBN AR 1/4885KDM4E 713/4885TP53 224/4885
US-11236051-B2 Compounds and methods for the targeted degradation of androgen receptor AR, ADRM1, CRBN AR 1/4885KDM4E 706/4885TP53 219/4885

“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.