SCHEMBL21995355

SCHEMBL21995355

C[CH]OC(=O)N(C)CC(=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
LMNA P02545 3/20 0.42
HCAR2 Q8TDS4 1/20 0.42
CDC25B P30305 1/20 0.42
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ABCB1 P08183 1/20 0.41

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
SCHEMBL2221455 0.82 ALDH1A1 (0.51) ALDH1A1MAPK1L3MBTL1MAPTHPGD
SCHEMBL6900506 0.82 ALDH1A1 (0.51) ALDH1A1MAPK1L3MBTL1MAPTHPGD
SCHEMBL25252134 0.81 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1MAPTHPGD
SCHEMBL2182699 0.81 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1MAPTHPGD
SCHEMBL6923340 0.80 ALDH1A1 (0.49) ALDH1A1MAPK1L3MBTL1MAPTHPGD
SCHEMBL7703626 0.80 ALDH1A1 (0.49) ALDH1A1MAPK1L3MBTL1MAPTHPGD
SCHEMBL9998357 0.79 ALDH1A1 (0.49) ALDH1A1MAPK1L3MBTL1MAPTHPGD
SCHEMBL21814404 0.79 ALDH1A1 (0.54) ALDH1A1MAPK1L3MBTL1MAPTHPGD
SCHEMBL6897847 0.79 ALDH1A1 (0.47) ALDH1A1MAPK1L3MBTL1MAPTHPGD
SCHEMBL23748824 0.78 ALDH1A1 (0.48) ALDH1A1MAPK1L3MBTL1MAPTHPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220106595-A1 ANTIBACTERIAL ANTISENSE AGENTS Pedanius Therapeutics Limited (GB) 2022-04-07 US disclosed
EP-3887520-A1 ANTIBACTERIAL ANTISENSE AGENTS Pedanius Therapeutics Limited (GB) 2021-10-06 EP disclosed
WO-2020109792-A1 ANTIBACTERIAL ANTISENSE AGENTS Pedanius Therapeutics Limited (GB) 2020-06-04 WO 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-20220106595-A1 ANTIBACTERIAL ANTISENSE AGENTS SLC47A1, SLC47A2, ZFR ALDH1A1 4038/4885MAPK1 3559/4885L3MBTL1 884/4885

“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.