SCHEMBL22354524

SCHEMBL22354524

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

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 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
SCHEMBL25587750 0.91 KDM4E (0.34) KDM4ETDP1TSHR
SCHEMBL344219 0.89 TDP1 (0.36) KDM4ETDP1TSHR
SCHEMBL1144943 0.89 TDP1 (0.40) KDM4ETDP1TSHR
SCHEMBL20994688 0.89 TDP1 (0.40) KDM4ETDP1TSHR
SCHEMBL20216922 0.89 TDP1 (0.40) KDM4ETDP1TSHR
SCHEMBL131477 0.89 TDP1 (0.40) KDM4ETDP1TSHR
SCHEMBL6381056 0.89 KDM4E (0.35) KDM4ETDP1TSHR
SCHEMBL19699299 0.88 MAPT (0.42) KDM4ETSHR
SCHEMBL25489387 0.86 TDP1 (0.35) KDM4ETDP1TSHR
SCHEMBL4749725 0.86 KDM4E (0.35) KDM4ETDP1TSHR

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-20230159581-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS SYNOVO GMBH (DE) 2023-05-25 US 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 (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-20230159581-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS CTSA, ALOX15, ALOX5 KDM4E 3648/4885TDP1 3576/4885TSHR 4450/4885
US-20200262857-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS CTSA, ALOX15, ALOX5 KDM4E 3648/4885TDP1 3576/4885TSHR 4450/4885

“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.