SCHEMBL29313402

SCHEMBL29313402

C=C(C)NC1CCN(C(=O)C(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 14/20 0.49
EPHX1 P07099 2/20 0.44
NPY5R Q15761 1/20 0.43
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP2D6 P10635 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL18560182 0.86 EPHX2 (0.51) EPHX2EPHX1NPY5RALDH1A1MEN1
SCHEMBL23573294 0.82 EPHX2 (0.51) EPHX2EPHX1NPY5RALDH1A1MEN1
SCHEMBL23011797 0.82 EPHX2 (0.51) EPHX2EPHX1NPY5RALDH1A1MEN1
SCHEMBL30884707 0.81 EPHX2 (0.51) EPHX2EPHX1NPY5RALDH1A1MEN1
SCHEMBL8341984 0.78 EPHX2 (0.47) EPHX2EPHX1NPY5RALDH1A1MEN1
SCHEMBL22916940 0.78 EPHX2 (0.52) EPHX2EPHX1NPY5RMEN1KMT2A
SCHEMBL22432772 0.77 EPHX2 (0.46) EPHX2EPHX1NPY5RALDH1A1MEN1
SCHEMBL10311742 0.76 KDM5A (0.50) EPHX2EPHX1NPY5R
SCHEMBL16368592 0.76 ALDH1A1 (0.49) EPHX2EPHX1ALDH1A1
SCHEMBL20665186 0.74 HSD11B1 (0.50) EPHX2ALDH1A1MEN1KMT2A

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 1 patent. 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 EPHX2 2834/4885EPHX1 2619/4885NPY5R 4632/4885

“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.