SCHEMBL4239226

SCHEMBL4239226

CCN(CCCN1CCCCC1)c1ccc(C#N)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.55
HRH2 P25021 2/20 0.49
HRH1 P35367 2/20 0.49
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
GFER P55789 1/20 0.48
KMT2A Q03164 1/20 0.48
SLC6A4 P31645 1/20 0.46
CACNA1B Q00975 2/20 0.41
EGLN1 Q9GZT9 1/20 0.41
CACNA1H O95180 1/20 0.41
KCNJ1 P48048 1/20 0.41
KCNH2 Q12809 1/20 0.41
SCN7A Q01118 1/20 0.40

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
SCHEMBL4235368 0.77 ALDH1A1 (0.47) HRH3HRH2HRH1KDM4EMEN1
SCHEMBL30239652 0.76 HRH3 (0.50) HRH3HRH2HRH1SLC6A4KCNJ1
SCHEMBL7468442 0.75 CYP2A6 (0.42) HRH3KDM4EMEN1ALDH1A1GFER
SCHEMBL12663039 0.74 ALDH1A1 (0.55) HRH3HRH1KDM4EMEN1ALDH1A1
SCHEMBL63804 0.74 ALDH1A1 (0.52) KDM4EMEN1ALDH1A1GFERKMT2A
SCHEMBL5296696 0.73 HRH3 (0.74) HRH3HRH2HRH1
SCHEMBL2156764 0.73 ALDH1A1 (0.55) HRH3KDM4EMEN1ALDH1A1GFER
SCHEMBL6555097 0.73 ALDH1A1 (0.50) HRH3KDM4EMEN1ALDH1A1GFER
SCHEMBL7498982 0.72 KCNJ1 (0.67) HRH3HRH2HRH1CACNA1BCACNA1H
Hydrochloric Acid SCHEMBL11222216 0.71 ALDH1A1 (0.53) HRH3KDM4EMEN1ALDH1A1GFER

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 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 (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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R HRH3 210/4885HRH2 162/4885HRH1 217/4885

“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.