SCHEMBL24767283

SCHEMBL24767283

CC[C@H]1CC[C@@](C)(NC(C)=O)CC1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
DRD2 P14416 2/20 0.35
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTT P42858 1/20 0.32

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
SCHEMBL25525597 0.78 DRD2 (0.33) DRD2ALDH1A1KDM4EHTT
SCHEMBL11817461 0.78 HTT (0.34) DRD2HTT
SCHEMBL12942820 0.78 HTT (0.34) DRD2HTT
SCHEMBL25149793 0.78 DPP4 (0.36) DRD2KDM4EHTT
SCHEMBL25568564 0.76 KMT2A (0.40) ALDH1A1GAA
SCHEMBL7991761 0.76
SCHEMBL24767282 0.75 CTSS (0.36) POLBKDM4E
SCHEMBL6845293 0.74 FFAR3 (0.54) POLBALDH1A1KDM4EGAAHPGD
SCHEMBL11573005 0.74 FFAR3 (0.54) POLBALDH1A1KDM4EGAAHPGD
SCHEMBL4761467 0.73 EPHX1 (0.37) DRD2ALDH1A1KDM4EGAAHTT

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-20220402910-A1 THIADIAZOLE IRAK4 INHIBITORS GILEAD SCIENCES, INC. 2022-12-22 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-20220402910-A1 THIADIAZOLE IRAK4 INHIBITORS IRAK4, IRAK3, IRAK1 POLB 2413/4885DRD2 3676/4885ALDH1A1 1763/4885

“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.