SCHEMBL4240820

SCHEMBL4240820

CCCCN1CCCN(c2ccc(C#N)cc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.64
DRD3 P35462 3/20 0.64
KDM4E B2RXH2 2/20 0.52
GAA P10253 1/20 0.52
HTR7 P34969 4/20 0.52
HRH3 Q9Y5N1 5/20 0.50
HRH1 P35367 2/20 0.50
HTR1A P08908 1/20 0.49
CHRNA10 Q9GZZ6 1/20 0.49
CHRNA9 Q9UGM1 1/20 0.49
TP53 P04637 1/20 0.49
HRH2 P25021 1/20 0.47

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
SCHEMBL4233204 0.94 DRD2 (0.70) DRD2DRD3KDM4EGAAHTR7
SCHEMBL13079493 0.85 DRD2 (0.68) DRD2DRD3KDM4EGAAHTR7
SCHEMBL29094360 0.82 KDM4E (0.58) DRD2DRD3KDM4EGAAHTR7
SCHEMBL5356200 0.80 KDM4E (0.62) DRD2DRD3KDM4EGAAHTR7
SCHEMBL3206275 0.78 CYP2D6 (0.58) DRD2DRD3KDM4EHTR7HRH3
SCHEMBL7487458 0.78 HRH3 (0.53) DRD2DRD3KDM4EHTR7HRH3
SCHEMBL7402909 0.78 KDM4E (0.68) DRD2DRD3KDM4EGAAHTR7
SCHEMBL153456 0.77 CHEK1 (0.61) KDM4EGAAHTR7HRH3HTR1A
SCHEMBL18396586 0.77 HRH3 (0.52) DRD2DRD3KDM4EHTR7HRH3
SCHEMBL1714712 0.77 HRH3 (0.77) DRD2DRD3HRH3HRH1HTR1A

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 DRD2 337/4885DRD3 384/4885KDM4E 1604/4885

“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.