SCHEMBL29313643

SCHEMBL29313643

Cc1cccc(C(=O)Nc2nc3cc(CN4CCN(CCOCC(=O)O)CC4)ccc3n2C2CCC(CO)CC2)c1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 12/20 0.61
MAP3K7 O43318 5/20 0.61
IRAK1 P51617 3/20 0.61
ALK Q9UM73 7/20 0.56
MET P08581 2/20 0.56
EGFR P00533 1/20 0.47

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
SCHEMBL29313639 0.93 IRAK4 (0.59) IRAK4MAP3K7IRAK1ALKMET
SCHEMBL20985274 0.90 IRAK4 (0.77) IRAK4MAP3K7IRAK1ALKMET
SCHEMBL20985273 0.90 IRAK4 (0.77) IRAK4MAP3K7IRAK1ALKMET
SCHEMBL21025911 0.90 IRAK4 (0.77) IRAK4MAP3K7IRAK1ALKMET
SCHEMBL29313593 0.87 IRAK4 (0.69) IRAK4MAP3K7IRAK1ALKMET
SCHEMBL29313515 0.87 IRAK4 (0.69) IRAK4MAP3K7IRAK1ALKMET
SCHEMBL29313616 0.85 IRAK4 (0.64) IRAK4MAP3K7IRAK1ALKMET
SCHEMBL20985323 0.84 IRAK4 (0.73) IRAK4MAP3K7IRAK1ALKMET
SCHEMBL21025641 0.84 IRAK4 (0.73) IRAK4MAP3K7IRAK1ALKMET
SCHEMBL20985321 0.84 IRAK4 (0.73) IRAK4MAP3K7IRAK1ALKMET

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 IRAK4 2/4885MAP3K7 533/4885IRAK1 1/4885

“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.