SCHEMBL16384405

SCHEMBL16384405

CCC(=O)NCCCCCN(C)C

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68
DNM1 Q05193 3/20 0.61
KDM4E B2RXH2 1/20 0.49
CASP2 P42575 1/20 0.47
PAOX Q6QHF9 1/20 0.46
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NAAA Q02083 1/20 0.44
TSHR P16473 1/20 0.44
EPHX1 P07099 2/20 0.42
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL25751510 0.98 MEN1 (0.71) MEN1KMT2ADNM1KDM4ECASP2
SCHEMBL7159679 0.92 MEN1 (0.67) MEN1KMT2ADNM1KDM4EPAOX
Hydrochloric Acid SCHEMBL30988427 0.90 MEN1 (0.64) MEN1KMT2ADNM1KDM4EPAOX
SCHEMBL25817165 0.88 MEN1 (0.68) MEN1KMT2ADNM1KDM4ECASP2
SCHEMBL25816679 0.86 MEN1 (0.71) MEN1KMT2ADNM1CASP2ALDH1A1
SCHEMBL9259257 0.85 MEN1 (0.94) MEN1KMT2AKDM4ECASP2ALDH1A1
SCHEMBL21765846 0.85 MEN1 (0.94) MEN1KMT2AKDM4ECASP2ALDH1A1
SCHEMBL11758762 0.85 MEN1 (0.94) MEN1KMT2AKDM4ECASP2ALDH1A1
SCHEMBL25816837 0.84 MEN1 (0.68) MEN1KMT2ADNM1CASP2ALDH1A1
SCHEMBL27450160 0.84 DNM1 (0.65) MEN1KMT2ADNM1KDM4ECASP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150005319-A1 MACROCYCLIC COMPOUNDS FOR MODULATING IL-17 ENSEMBLE THERAPEUTICS CORPORATION 2015-01-01 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-20150005319-A1 MACROCYCLIC COMPOUNDS FOR MODULATING IL-17 IL17A, IL15, IL2 MEN1 1132/4885KMT2A 3399/4885DNM1 2507/4885

“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.