SCHEMBL22354590

SCHEMBL22354590

CCOC(=O)C(O)CN1CCCN(CC(O)C(=O)OCC)CC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP2D6 P10635 1/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HSD17B10 Q99714 1/20 0.37
MAPT P10636 4/20 0.37
LMNA P02545 2/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TSHR P16473 2/20 0.36
ATM Q13315 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL2959602 0.94 KMT2A (0.43) ALDH1A1KDM4EKMT2AMEN1L3MBTL1
SCHEMBL26421960 0.93 ALDH1A1 (0.38) ALDH1A1KDM4ECYP2D6KMT2AMEN1
SCHEMBL11154925 0.82 KMT2A (0.32) ALDH1A1KDM4ECYP2D6KMT2AMEN1
SCHEMBL840429 0.81 MEN1 (0.40) ALDH1A1KDM4ECYP2D6KMT2AMEN1
SCHEMBL840430 0.81 MEN1 (0.40) ALDH1A1KDM4ECYP2D6KMT2AMEN1
SCHEMBL23886367 0.78 ALDH1A1 (0.41) ALDH1A1KDM4EKMT2AMEN1L3MBTL1
SCHEMBL22354443 0.77 ALDH1A1 (0.36) ALDH1A1KDM4EKMT2AMEN1L3MBTL1
SCHEMBL31758131 0.77 MEN1 (0.45) ALDH1A1KDM4ECYP2D6KMT2AMEN1
SCHEMBL23886381 0.76 L3MBTL1 (0.37) ALDH1A1KDM4ECYP2D6KMT2AL3MBTL1
SCHEMBL25322115 0.76 CHRM2 (0.49) ALDH1A1CYP2D6KMT2AMEN1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159581-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS SYNOVO GMBH (DE) 2023-05-25 US disclosed
US-20230159581-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS SYNOVO GMBH (DE) 2023-05-25 US disclosed
US-20230131943-A1 ANTI-INFECTIVE AND ANTI-VIRAL COMPOUNDS AND COMPOSITIONS BURNET MICHEAL W (DE) 2023-04-27 US disclosed
US-20230131943-A1 ANTI-INFECTIVE AND ANTI-VIRAL COMPOUNDS AND COMPOSITIONS BURNET MICHEAL W (DE) 2023-04-27 US disclosed
WO-2021195126-A1 ANTI-INFECTIVE AND ANTI-VIRAL COMPOUNDS AND COMPOSITIONS BURNET MICHAEL W (DE) 2021-09-30 WO disclosed
US-20200262857-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS SYNOVO GMBH (DE) 2020-08-20 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 (3 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-20230131943-A1 ANTI-INFECTIVE AND ANTI-VIRAL COMPOUNDS AND COMPOSITIONS CTSA, GAA, SLC7A5 ALDH1A1 3317/4885KDM4E 3394/4885CYP2D6 3319/4885
US-20230159581-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS CTSA, ALOX15, ALOX5 ALDH1A1 947/4885KDM4E 3648/4885CYP2D6 2449/4885
US-20200262857-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS CTSA, ALOX15, ALOX5 ALDH1A1 947/4885KDM4E 3648/4885CYP2D6 2449/4885

“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.