SCHEMBL21026133

SCHEMBL21026133

CC1CCN(CCC2CCN(CC(=O)NC(C)C)CC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.50
CHRM3 P20309 1/20 0.50
HTT P42858 3/20 0.46
POLB P06746 1/20 0.46
ALDH1A1 P00352 6/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HRH3 Q9Y5N1 1/20 0.42
KDM4E B2RXH2 2/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
RAD52 P43351 1/20 0.42
GFER P55789 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALOX15 P16050 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
SCHEMBL21472815 0.89 SIGMAR1 (0.51) CHRM5CHRM3HTTPOLBALDH1A1
SCHEMBL21026129 0.88 CHRM5 (0.55) CHRM5CHRM3HTTPOLBALDH1A1
SCHEMBL23862112 0.88 CHRM5 (0.62) CHRM5CHRM3HTTPOLBALDH1A1
SCHEMBL20234781 0.84 HTT (0.49) HTTPOLBALDH1A1SMN1; SMN2MEN1
SCHEMBL21026131 0.81 POLB (0.49) CHRM5CHRM3HTTPOLBMEN1
SCHEMBL21026134 0.80 CHRM5 (0.53) CHRM5CHRM3HTTPOLBALDH1A1
SCHEMBL22006816 0.78 HTT (0.47) HTTPOLBALDH1A1SMN1; SMN2KDM4E
SCHEMBL29328061 0.77 CHRM5 (0.49) CHRM5CHRM3HTTPOLBALDH1A1
SCHEMBL29328199 0.77 CHRM5 (0.49) CHRM5CHRM3HTTPOLBALDH1A1
SCHEMBL29324283 0.77 CHRM5 (0.49) CHRM5CHRM3HTTPOLBALDH1A1

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-11161841-B2 Modulators of proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2021-11-02 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-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2019-10-17 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 CHRM5 4585/4885CHRM3 4601/4885HTT 902/4885
US-11065231-B2 Compounds and methods for the targeted degradation of interleukin-1 receptor- associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 CHRM5 4585/4885CHRM3 4601/4885HTT 902/4885
US-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE MDM2, CRBN, VHL CHRM5 4497/4885CHRM3 4695/4885HTT 748/4885
US-11161841-B2 Modulators of proteolysis and associated methods of use MDM2, CRBN, VHL CHRM5 4497/4885CHRM3 4695/4885HTT 748/4885

“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.