SCHEMBL25489028

SCHEMBL25489028

CCOC(=O)CCN(CCOC)Cc1ccc(OC)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.46
ALOX15 P16050 1/20 0.45
ALDH1A1 P00352 4/20 0.44
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 2/20 0.43
USP2 O75604 2/20 0.43
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
MEN1 O00255 1/20 0.43
TSHR P16473 1/20 0.43
MEP1B Q16820 1/20 0.42
GLA P06280 1/20 0.42
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALOX5 P09917 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
L3MBTL1 Q9Y468 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
SCHEMBL9833066 0.87 ALDH1A1 (0.48) LTA4HALOX15ALDH1A1GAASMN1; SMN2
SCHEMBL13435485 0.85 LTA4H (0.45) LTA4HALDH1A1SMN1; SMN2KMT2AUSP2
SCHEMBL9831172 0.85 USP2 (0.46) LTA4HALOX15ALDH1A1GAASMN1; SMN2
SCHEMBL28987474 0.84 USP2 (0.53) ALDH1A1SMN1; SMN2HTTKMT2AUSP2
SCHEMBL14182347 0.79 ALDH1A1 (0.43) LTA4HALDH1A1GAASMN1; SMN2KMT2A
SCHEMBL14182312 0.79 ALDH1A1 (0.43) LTA4HALDH1A1GAASMN1; SMN2KMT2A
SCHEMBL23857640 0.78 MEP1B (0.58) ALDH1A1GAASMN1; SMN2HTTKMT2A
SCHEMBL9324850 0.78 SMN1; SMN2 (0.55) LTA4HALDH1A1SMN1; SMN2KMT2ABCHE
SCHEMBL17230510 0.77 TSHR (0.49) TSHR
SCHEMBL10258588 0.77 TDP1 (0.48) LTA4HALOX15ALDH1A1GAAACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230146675-A1 PYRIMIDO[5,4-d]PYRIMIDINE DERIVATIVES AS ENT INHIBITORS FOR THE TREATMENT OF CANCERS, AND COMBINATION THEREOF WITH ADENOSINE RECEPTOR ANTAGONISTS iTeos Belgium SA (BE) 2023-05-11 US disclosed
US-20230146675-A1 PYRIMIDO[5,4-d]PYRIMIDINE DERIVATIVES AS ENT INHIBITORS FOR THE TREATMENT OF CANCERS, AND COMBINATION THEREOF WITH ADENOSINE RECEPTOR ANTAGONISTS iTeos Belgium SA (BE) 2023-05-11 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-20230146675-A1 PYRIMIDO[5,4-d]PYRIMIDINE DERIVATIVES AS ENT INHIBITORS FOR THE TREATMENT OF CANCERS, AND COMBINATION THEREOF WITH ADENOSINE RECEPTOR ANTAGONISTS ENTPD5, ENTPD1, SLC29A1 LTA4H 776/4885ALOX15 945/4885ALDH1A1 226/4885

“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.