SCHEMBL5714331

SCHEMBL5714331

O=C(Oc1ccc(CCOc2cccnc2)cc1)N1CCN(CCc2nccs2)CC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 14/20 0.48
DRD3 P35462 14/20 0.48
CYP3A4 P08684 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
USP2 O75604 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TP53 P04637 1/20 0.45
CYP2D6 P10635 1/20 0.45
CHRNB2 P17787 1/20 0.43
CHRNA4 P43681 1/20 0.43
LTA4H P09960 1/20 0.42

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
SCHEMBL5715075 0.89 THRB (0.49) DRD3CYP3A4SMN1; SMN2USP2ALDH1A1
SCHEMBL5714812 0.87 DRD2 (0.52) DRD2DRD3CHRNB2CHRNA4LTA4H
SCHEMBL5714879 0.85 CYP3A4 (0.48) DRD3CYP3A4SMN1; SMN2USP2ALDH1A1
SCHEMBL5714989 0.84 DRD2 (0.49) DRD2DRD3TP53
SCHEMBL5715452 0.83 DRD2 (0.50) DRD2DRD3
SCHEMBL5714238 0.83 SIGMAR1 (0.53) DRD2DRD3ALDH1A1CHRNB2CHRNA4
SCHEMBL5714356 0.83 DRD2 (0.47) DRD2DRD3
SCHEMBL5715454 0.82 DRD2 (0.58) DRD2DRD3
SCHEMBL5715463 0.82 DRD2 (0.48) DRD2DRD3CHRNB2CHRNA4
SCHEMBL5714273 0.82 KDM4E (0.52) DRD2DRD3CYP3A4USP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2006527212-A 2006-11-30 JP claimed
US-20060160820-A1 Substituted piperazine carbamates NOVO NORDISK A/S (DK) 2006-07-20 US claimed
EP-1636187-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2006-03-22 EP claimed
WO-2004111004-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2004-12-23 WO claimed
US-20060160820-A1 Substituted piperazine carbamates NOVO NORDISK A/S (DK) 2006-07-20 US disclosed
EP-1636187-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2006-03-22 EP disclosed
WO-2004111004-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2004-12-23 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-20060160820-A1 Substituted piperazine carbamates LIPE, PNLIP, LPL DRD2 3721/4885DRD3 3085/4885CYP3A4 1537/4885

“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.