SCHEMBL29313607

SCHEMBL29313607

CCOC(=O)C1CCC(n2c(NC(=O)c3cccc(C)c3)nc3cc(C=O)ccc32)CC1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 3/20 0.55
MET P08581 1/20 0.55
EGFR P00533 13/20 0.53
HDAC6 Q9UBN7 1/20 0.49
IRAK4 Q9NWZ3 4/20 0.47
MAP3K7 O43318 1/20 0.44

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
SCHEMBL21026258 0.90 EGFR (0.64) ALKMETEGFRHDAC6IRAK4
SCHEMBL29937318 0.90 EGFR (0.64) ALKMETEGFRHDAC6IRAK4
SCHEMBL29313605 0.88 ALK (0.60) ALKMETEGFRIRAK4MAP3K7
SCHEMBL21026264 0.79 EGFR (0.71) ALKMETEGFRIRAK4MAP3K7
SCHEMBL29937745 0.79 EGFR (0.71) ALKMETEGFRIRAK4MAP3K7
SCHEMBL21025772 0.79 EGFR (0.71) ALKMETEGFRIRAK4MAP3K7
SCHEMBL1925640 0.79 EGFR (0.66) ALKMETEGFRIRAK4MAP3K7
SCHEMBL29937945 0.79 EGFR (0.66) ALKMETEGFRIRAK4MAP3K7
SCHEMBL13500557 0.79 EGFR (0.66) ALKMETEGFRIRAK4MAP3K7
SCHEMBL1925637 0.79 EGFR (0.66) ALKMETEGFRIRAK4MAP3K7

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 ALK 746/4885MET 234/4885EGFR 349/4885

“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.