SCHEMBL6820944

SCHEMBL6820944

CCN(CC)CCCCC(C)=O

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 4/20 0.69
KDM5A P29375 4/20 0.44
KDM4C Q9H3R0 2/20 0.44
ALDH1A1 P00352 2/20 0.41
APOBEC3A P31941 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
ACHE P22303 3/20 0.39
BCHE P06276 2/20 0.39
MAOB P27338 2/20 0.38
NPSR1 Q6W5P4 1/20 0.37
PHF8 Q9UPP1 2/20 0.37
GAA P10253 1/20 0.37
LMNA P02545 1/20 0.36

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
SCHEMBL6820435 0.98 PAOX (0.72) PAOXKDM5AKDM4CALDH1A1APOBEC3A
SCHEMBL164414 0.93 PAOX (0.66) PAOXKDM5AKDM4CALDH1A1APOBEC3A
SCHEMBL18550462 0.84 KDM5A (0.55) PAOXKDM5AKDM4CPHF8
SCHEMBL1147352 0.83 PAOX (0.50) PAOXKDM5AKDM4CALDH1A1APOBEC3A
SCHEMBL2178380 0.82 PAOX (0.53) PAOXALDH1A1APOBEC3AAPOBEC3GACHE
SCHEMBL24372448 0.82 PAOX (0.55) PAOXKDM5AKDM4CALDH1A1PHF8
SCHEMBL18858465 0.82 PAOX (0.55) PAOXKDM5AKDM4CALDH1A1PHF8
SCHEMBL6668912 0.81 PAOX (0.48) PAOXKDM5AKDM4CALDH1A1APOBEC3A
SCHEMBL5393582 0.81 KDM5A (0.58) KDM5AKDM4CALDH1A1PHF8LMNA
SCHEMBL6252756 0.80 PAOX (0.58) PAOXKDM5AKDM4CALDH1A1APOBEC3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160303062-A1 ANTIMICROBIAL COMPOSITIONS AND METHOD OF USE NATIONAL SCIENCE FOUNDATION 2016-10-20 US disclosed
US-9380784-B2 Antimicrobial compositions and methods of use NATIONAL SCIENCE FOUNDATION 2016-07-05 US disclosed
US-20160139136-A1 RAPID FLUORESCENCE TAGGING OF GLYCANS AND OTHER BIOMOLECULES WITH ENHANCED MS SIGNALS WATERS TECHNOLOGIES CORPORATION (US) 2016-05-19 US disclosed
US-20110165261-A1 ANTIMICROBIAL COMPOSITIONS AND METHODS OF USE GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC (US) 2011-07-07 US disclosed
WO-2004041781-A1 PREPARATION OF 3-AMINOALKYL-SUBSTITUTED INDOLE DERIVATIVES FROM PHENYLHYDRAZINES AND AMINOKETONES SUVEN LIFE SCIENCES LIMITED (IN) 2004-05-21 WO 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-20160303062-A1 ANTIMICROBIAL COMPOSITIONS AND METHOD OF USE MPO, CUTA, LPO PAOX 3362/4885KDM5A 3904/4885KDM4C 4315/4885
US-20160139136-A1 RAPID FLUORESCENCE TAGGING OF GLYCANS AND OTHER BIOMOLECULES WITH ENHANCED MS SIGNALS FUT5, FUT6, CSGALNACT1 PAOX 3475/4885KDM5A 3734/4885KDM4C 4213/4885
US-20110165261-A1 ANTIMICROBIAL COMPOSITIONS AND METHODS OF USE MPO, CUTA, LPO PAOX 3514/4885KDM5A 3927/4885KDM4C 4227/4885

“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.