SCHEMBL13744835

SCHEMBL13744835

CC1CCN(C2CCN(C(C)C)CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.42
POLB P06746 1/20 0.42
DHCR7 Q9UBM7 3/20 0.40
EBP Q15125 2/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HRH3 Q9Y5N1 8/20 0.35
TLR9 Q9NR96 2/20 0.34
TLR8 Q9NR97 2/20 0.34
TLR7 Q9NYK1 2/20 0.34
ALDH1A1 P00352 1/20 0.34
L3MBTL3 Q96JM7 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MBTD1 Q05BQ5 1/20 0.34
CYP2D6 P10635 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL23384368 1.00 KDM4E (0.42) KDM4EPOLBDHCR7EBPMEN1
SCHEMBL24828016 0.88 HRH3 (0.33) KDM4EPOLBDHCR7HRH3TLR9
SCHEMBL24854350 0.88 HRH3 (0.34) KDM4EPOLBDHCR7EBPHRH3
SCHEMBL12030661 0.88 HRH3 (0.34) KDM4EPOLBDHCR7EBPHRH3
SCHEMBL24726517 0.86 HRH3 (0.40) HRH3TLR9TLR8TLR7L3MBTL3
SCHEMBL23384260 0.86 HRH3 (0.40) HRH3TLR9TLR8TLR7L3MBTL3
SCHEMBL105496 0.86 ALDH1A1 (0.41) MEN1KMT2AHRH3ALDH1A1CYP2D6
SCHEMBL26029903 0.85 HRH3 (0.37) KDM4EHRH3TLR9TLR8TLR7
SCHEMBL25605624 0.85 ACHE (0.50) KDM4EPOLBDHCR7EBPMEN1
SCHEMBL14453902 0.84 HRH3 (0.41) HRH3TLR9TLR8TLR7L3MBTL3

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-3041841-B1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF HOFFMANN LA ROCHE (CH) 2019-06-05 EP disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 US disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 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-20090209511-A1 Benzofuran Derivatives F12, F2, F3 KDM4E 1464/4885POLB 1805/4885DHCR7 3819/4885

“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.