SCHEMBL5066970

SCHEMBL5066970

CCC(N1CCNCCNCC1)N1CCNCCNCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.35
SLC6A2 P23975 6/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
OPRD1 P41143 6/20 0.34
CYP2D6 P10635 2/20 0.32
CYP19A1 P11511 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
CXCR4 P61073 1/20 0.31
SLC6A3 Q01959 2/20 0.31
CACNA1F O60840 1/20 0.31
CYP3A4 P08684 1/20 0.31
CACNA1D Q01668 1/20 0.31
KCNH2 Q12809 1/20 0.31
CACNA1S Q13698 1/20 0.31
CACNA1C Q13936 1/20 0.31
CHRM5 P08912 1/20 0.31

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
SCHEMBL6556075 0.97 SLC6A4 (0.36) SLC6A4SLC6A2MEN1KMT2AOPRD1
SCHEMBL2673825 0.91 SLC6A2 (0.33) SLC6A4SLC6A2MEN1KMT2AOPRD1
SCHEMBL5584107 0.89 CXCR4 (0.42) SLC6A4SLC6A2MEN1KMT2AOPRD1
SCHEMBL28226868 0.89 SIGMAR1 (0.36) SLC6A4SLC6A2MEN1KMT2AOPRD1
SCHEMBL2958702 0.85 KMT2A (0.35) SLC6A4SLC6A2MEN1KMT2AOPRD1
SCHEMBL6578962 0.81 SIGMAR1 (0.36) SLC6A4SLC6A2MEN1KMT2AOPRD1
SCHEMBL11724424 0.78 SIGMAR1 (0.37) SLC6A4SLC6A2MEN1KMT2AOPRD1
SCHEMBL30611837 0.78 KDM4E (0.36) SLC6A4SLC6A2MEN1KMT2AOPRD1
SCHEMBL9695357 0.78
SCHEMBL510134 0.77 SLC6A2 (0.39) SLC6A4SLC6A2MEN1KMT2AOPRD1

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-20080293917-A1 Peptide Purification By Means Of Metal Ion Affinity Chromatography NOVO NORDISK A/S (DK) 2008-11-27 US disclosed
US-20060287432-A1 Peptide purification by means of metal ion affinity chromatography NOVO NORDISK A/S (DK) 2006-12-21 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-20080293917-A1 Peptide Purification By Means Of Metal Ion Affinity Chromatography NGLY1, VIP, NPPA SLC6A4 1968/4885SLC6A2 2375/4885MEN1 1589/4885
US-20060287432-A1 Peptide purification by means of metal ion affinity chromatography NGLY1, VIP, NPPA SLC6A4 1968/4885SLC6A2 2375/4885MEN1 1589/4885

“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.