SCHEMBL25587750

SCHEMBL25587750

CC(O)CN(CCCCN(CC(C)O)CC(C)O)CCCN(CC(C)O)CC(C)O

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
TSHR P16473 3/20 0.32
RECQL P46063 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL6381056 0.97 KDM4E (0.35) KDM4ETSHRRECQLTDP1ALDH1A1
SCHEMBL9492420 0.95 KDM4E (0.36) KDM4ETSHRRECQLTDP1ALDH1A1
SCHEMBL436610 0.95 KDM4E (0.36) KDM4ETSHRRECQLTDP1ALDH1A1
SCHEMBL973693 0.92 KDM4E (0.35) KDM4ETSHRRECQLTDP1ALDH1A1
SCHEMBL30799893 0.92 KDM4E (0.35) KDM4ETSHRRECQLTDP1ALDH1A1
SCHEMBL22354524 0.91 KDM4E (0.33) KDM4ETSHRTDP1
SCHEMBL9640925 0.87 CYP1A2 (0.36) KDM4ETSHRRECQLTDP1
SCHEMBL9640755 0.86 DNM1 (0.36) KDM4ETDP1
SCHEMBL6260966 0.86 KDM4E (0.38) KDM4ETSHRRECQLTDP1ALDH1A1
SCHEMBL1446865 0.86 KDM4E (0.38) KDM4ETSHRRECQLTDP1ALDH1A1

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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 KDM4E 3394/4885TSHR 4510/4885RECQL 4000/4885
US-20230159581-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS CTSA, ALOX15, ALOX5 KDM4E 3648/4885TSHR 4450/4885RECQL 4056/4885

“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.