SCHEMBL4872075

SCHEMBL4872075

O=C(NCCCN1CCOCC1)C1CC1c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.68
ALDH1A1 P00352 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
KDM4E B2RXH2 1/20 0.58
DRD2 P14416 1/20 0.57
DRD3 P35462 1/20 0.57
POLB P06746 1/20 0.57
GAA P10253 2/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C19 P33261 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.53
MAPK1 P28482 1/20 0.53

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
SCHEMBL4871963 0.93 SIGMAR1 (0.79) SIGMAR1ALDH1A1KDM4EDRD2DRD3
SCHEMBL4870310 0.81 SIGMAR1 (1.00) SIGMAR1ALDH1A1DRD2DRD3POLB
SCHEMBL4870315 0.81 SIGMAR1 (1.00) SIGMAR1ALDH1A1DRD2DRD3POLB
SCHEMBL4867118 0.80 SIGMAR1 (0.97) SIGMAR1DRD2DRD3POLB
SCHEMBL5180920 0.77 SIGMAR1 (0.80) SIGMAR1ALDH1A1DRD2DRD3POLB
SCHEMBL5180929 0.77 SIGMAR1 (0.80) SIGMAR1ALDH1A1DRD2DRD3POLB
SCHEMBL4876861 0.77 SIGMAR1 (1.00) SIGMAR1DRD2DRD3POLBCYP2D6
SCHEMBL4876867 0.77 SIGMAR1 (1.00) SIGMAR1DRD2DRD3POLBCYP2D6
SCHEMBL4874862 0.77 SIGMAR1 (1.00) SIGMAR1ALDH1A1SMN1; SMN2KDM4EDRD2
SCHEMBL4874859 0.77 SIGMAR1 (1.00) SIGMAR1ALDH1A1SMN1; SMN2KDM4EDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080153917-A1 Sigma Receptor Ligands UCB PHARMA, S.A. (BE) 2008-06-26 US claimed
EP-1797036-A1 SIGMA RECEPTOR LIGANDS UCB Pharma, S.A. (BE) 2007-06-20 EP claimed
WO-2006027252-A1 SIGMA RECEPTOR LIGANDS UCB PHARMA, SA (BE) 2006-03-16 WO claimed
US-20080153917-A1 Sigma Receptor Ligands UCB PHARMA, S.A. (BE) 2008-06-26 US disclosed
EP-1797036-A1 SIGMA RECEPTOR LIGANDS UCB Pharma, S.A. (BE) 2007-06-20 EP disclosed
WO-2006027252-A1 SIGMA RECEPTOR LIGANDS UCB PHARMA, SA (BE) 2006-03-16 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-20080153917-A1 Sigma Receptor Ligands SIGMAR1, TMEM97, OPRL1 SIGMAR1 1/4885ALDH1A1 2385/4885SMN1; SMN2 3639/4885

“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.