SCHEMBL17277607

SCHEMBL17277607

CC1CCCN(CCOCCO)C1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.55
HRH3 Q9Y5N1 10/20 0.52
ALDH1A1 P00352 2/20 0.49
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
GAA P10253 1/20 0.46

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
SCHEMBL15101577 0.86 HRH3 (0.65) KDM4EHRH3ALDH1A1
SCHEMBL12449641 0.83 KDM4E (0.54) KDM4EHRH3LMNASMN1; SMN2GAA
SCHEMBL13102 0.83 KDM4E (0.54) KDM4EHRH3LMNASMN1; SMN2GAA
SCHEMBL2114689 0.82 KDM4E (0.49) KDM4EHRH3ALDH1A1
SCHEMBL738472 0.82 KDM4E (0.49) KDM4EHRH3ALDH1A1
SCHEMBL12449637 0.82 KDM4E (0.51) KDM4EHRH3ALDH1A1LMNASMN1; SMN2
SCHEMBL12449635 0.82 KDM4E (0.51) KDM4EHRH3ALDH1A1LMNASMN1; SMN2
SCHEMBL13003 0.82 KDM4E (0.51) KDM4EHRH3ALDH1A1LMNASMN1; SMN2
SCHEMBL17277355 0.81 KDM4E (0.39) KDM4EHRH3ALDH1A1LMNASMN1; SMN2
SCHEMBL12062331 0.80 KDM4E (0.38) KDM4EHRH3SMN1; SMN2

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
EP-2488525-B1 ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME MELINTA THERAPEUTICS INC (US) 2018-04-25 EP disclosed
US-20160031893-A1 ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME BioVersys AG (CH) 2016-02-04 US disclosed
US-9193731-B2 Antimicrobial compounds and methods of making and using the same MELINTA THERAPEUTICS, INC. (US) 2015-11-24 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-20160031893-A1 ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME MPO, LPO, CAT KDM4E 4344/4885HRH3 3537/4885ALDH1A1 1117/4885

“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.