SCHEMBL26290355

SCHEMBL26290355

CCC(=O)[C@H]1C[C@@H]1c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.56
ALDH1A1 P00352 2/20 0.54
HRH3 Q9Y5N1 4/20 0.52
SIGMAR1 Q99720 3/20 0.52
SLC9A1 P19634 1/20 0.51
HPGD P15428 1/20 0.49
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
DEGS1 O15121 1/20 0.47
FFAR1 O14842 1/20 0.47
GPR88 Q9GZN0 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
SCHEMBL13911289 1.00 HDAC4 (0.56) HDAC4ALDH1A1HRH3SIGMAR1SLC9A1
SCHEMBL14038424 1.00 HDAC4 (0.56) HDAC4ALDH1A1HRH3SIGMAR1SLC9A1
SCHEMBL6560499 1.00 HDAC4 (0.56) HDAC4ALDH1A1HRH3SIGMAR1SLC9A1
SCHEMBL14038418 1.00 HDAC4 (0.56) HDAC4ALDH1A1HRH3SIGMAR1SLC9A1
SCHEMBL17029589 0.83 HRH3 (0.51) HDAC4ALDH1A1HRH3SIGMAR1SLC9A1
SCHEMBL28004384 0.82 SLC9A1 (0.54) ALDH1A1HRH3SLC9A1HPGDGPR88
SCHEMBL14767822 0.81 ALDH1A1 (0.59) HDAC4ALDH1A1SIGMAR1SLC9A1HPGD
SCHEMBL6560503 0.81 HDAC4 (0.51) HDAC4ALDH1A1HRH3SIGMAR1SLC9A1
SCHEMBL6560500 0.81 HDAC4 (0.51) HDAC4ALDH1A1HRH3SIGMAR1SLC9A1
SCHEMBL21093386 0.80 NAMPT (0.55) GPR88

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-11732005-B2 Peptidomimetic proteasome inhibitors CORNELL UNIVERSITY (US) 2023-08-22 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-11732005-B2 Peptidomimetic proteasome inhibitors PSMB1, PSMB3, PSMB11 HDAC4 563/4885ALDH1A1 4635/4885HRH3 1793/4885

“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.