SCHEMBL25878281

SCHEMBL25878281

CCCCOC[C@H]1CC[C@H](c2nc3cc(C(=O)OC)c(NC(=O)c4cccc(C(F)(F)F)c4)cc3s2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PCSK9 Q8NBP7 2/20 0.41
CSF1R P07333 1/20 0.40
PDE4B Q07343 2/20 0.39
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
CCNA1 P78396 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
EGFR P00533 1/20 0.38
CCR2 P41597 2/20 0.37
ALDH1A1 P00352 2/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37
MAP3K7 O43318 2/20 0.37
IRAK4 Q9NWZ3 2/20 0.37
RIPK1 Q13546 1/20 0.36
PTPN1 P18031 1/20 0.36
KCNH2 Q12809 1/20 0.36
POLB P06746 2/20 0.36

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
SCHEMBL25726460 0.95 PCSK9 (0.37) PCSK9CSF1RPDE4BEGFRALDH1A1
SCHEMBL25726424 0.90 PCSK9 (0.44) PCSK9CSF1RPDE4BCCNA2CDK2
SCHEMBL23539386 0.89 EGFR (0.40) PCSK9CSF1RPDE4BCCNA2CDK2
SCHEMBL25732652 0.89 EGFR (0.40) PCSK9CSF1RPDE4BCCNA2CDK2
SCHEMBL23539676 0.89 IRAK4 (0.46) PCSK9CSF1RPDE4BCCNA2CDK2
SCHEMBL23568599 0.89 IRAK4 (0.46) PCSK9CSF1RPDE4BCCNA2CDK2
SCHEMBL25878285 0.86 IRAK4 (0.43) IRAK4
SCHEMBL23539622 0.84 RXFP1 (0.37) PCSK9CSF1RPDE4BEGFRALDH1A1
SCHEMBL23568525 0.84 RXFP1 (0.37) PCSK9CSF1RPDE4BEGFRALDH1A1
SCHEMBL23672368 0.83 IRAK4 (0.42) PCSK9CSF1RPDE4BCCNA2CDK2

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-11707457-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-07-25 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-11707457-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 PCSK9 102/4885CSF1R 615/4885PDE4B 1609/4885

“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.