SCHEMBL14723638

SCHEMBL14723638

CNC(=O)CCCCCCC(=O)Oc1ccccc1C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
KDM4E B2RXH2 2/20 0.51
RECQL P46063 1/20 0.51
HDAC6 Q9UBN7 2/20 0.48
NR1I2 O75469 1/20 0.48
LMNA P02545 1/20 0.48
CHRM2 P08172 1/20 0.48
CYP3A4 P08684 1/20 0.48
ADRA2A P08913 1/20 0.48
MAPT P10636 1/20 0.48
OPRK1 P41145 1/20 0.48
HTR2B P41595 1/20 0.48
SLC6A3 Q01959 1/20 0.48
IRAK4 Q9NWZ3 1/20 0.47
HDAC8 Q9BY41 2/20 0.45
HDAC1 Q13547 2/20 0.45
HTT P42858 1/20 0.45
PARP1 P09874 1/20 0.44
CTNNB1 P35222 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
SCHEMBL13425200 0.88 HDAC1 (0.56) MEN1KMT2AKDM4ERECQLHDAC6
SCHEMBL14723636 0.86 SLC6A3 (0.51) MEN1KMT2AKDM4ERECQLMAPT
SCHEMBL25278027 0.85 MEN1 (0.67) MEN1KMT2AKDM4ERECQLHDAC6
SCHEMBL14723633 0.85 HDAC1 (0.51) MEN1KMT2AKDM4ERECQLHDAC6
SCHEMBL9568702 0.84 KDM4E (0.59) MEN1KMT2AKDM4ERECQLHDAC6
SCHEMBL29280366 0.83 KDM4E (0.54) MEN1KMT2AKDM4ERECQLHDAC6
SCHEMBL27896046 0.83 MEN1 (0.65) MEN1KMT2AKDM4ERECQLHDAC6
SCHEMBL14723637 0.83 KDM4E (0.51) MEN1KMT2AKDM4ERECQLCYP3A4
SCHEMBL4564560 0.83 KDM4E (0.56) MEN1KMT2AKDM4ERECQLHDAC6
SCHEMBL28286962 0.81 KDM4E (0.75) MEN1KMT2AKDM4ERECQLHDAC6

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-9199923-B2 Histone deacetylase inhibitors PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-12-01 US disclosed
US-20150038581-A1 HISTONE DEACETYLASE INHIBITORS Harvard University & Medical School 2015-02-05 US disclosed
US-8383855-B2 Histone deacetylase inhibitors PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2013-02-26 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-20150038581-A1 HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC11, HDAC7 MEN1 888/4885KMT2A 38/4885KDM4E 172/4885

“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.