SCHEMBL5714647

SCHEMBL5714647

Cc1cccc(CCN2CCN(C(=O)Oc3ccc(CCN4C(=O)CC(C)(C)CC4=O)cn3)CC2)n1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.36
DRD2 P14416 1/20 0.36
HTR2A P28223 1/20 0.36
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C19 P33261 2/20 0.35
HTR1D P28221 2/20 0.35
HTR1B P28222 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
KCNH2 Q12809 2/20 0.35
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
CYP4F2 P78329 1/20 0.34
PRKAA2 P54646 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
SCHEMBL5715167 0.95 HTR1A (0.38) HTR1ADRD2HTR2A
SCHEMBL5715203 0.94 KDM4E (0.37) HTR1ADRD2HTR2ACYP3A4CYP2D6
SCHEMBL5715072 0.90 MGLL (0.38) CYP3A4CYP2D6CYP2C19KCNH2
SCHEMBL5714515 0.88 TP53 (0.43) HTR1ADRD2HTR2AKDM4E
SCHEMBL6103192 0.87 KCNH2 (0.36) HTR1ACYP3A4CYP2D6CYP2C19HTR1D
SCHEMBL5715321 0.87 HTR1A (0.39) HTR1ADRD2HTR2A
SCHEMBL5714952 0.87 HRH3 (0.36) HTR1ADRD2HTR2ACYP2D6CYP1A2
SCHEMBL5714780 0.86 PKM (0.37) HTR1ADRD2HTR2ACYP4F2
SCHEMBL5715533 0.85 HTR1A (0.35) HTR1ADRD2HTR2APOLBCYP4F2
SCHEMBL5715173 0.85 FAAH (0.40) HTR1ADRD2HTR2A

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 HTR1A 2790/4885DRD2 3721/4885HTR2A 1618/4885

“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.