SCHEMBL5714958

SCHEMBL5714958

Cc1ccc(CCCN2CCN(C(=O)Oc3ccc(Cc4ccc(C)cn4)cc3)CC2)nc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.44
ADORA3 P0DMS8 1/20 0.44
HTR2A P28223 1/20 0.44
HTR7 P34969 1/20 0.44
OPRM1 P35372 1/20 0.44
DRD2 P14416 1/20 0.43
HRH2 P25021 10/20 0.41
HRH1 P35367 10/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
FAAH O00519 2/20 0.40
MGLL Q99685 1/20 0.40
AOC3 Q16853 1/20 0.39

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
SCHEMBL5714944 0.94 CYP1A2 (0.43) CYP1A2CYP2C9CYP2C19AOC3
SCHEMBL5714875 0.94 TP53 (0.47) SIGMAR1ADORA3HTR2AHTR7OPRM1
SCHEMBL5714921 0.94 DRD2 (0.42) SIGMAR1ADORA3HTR2AHTR7OPRM1
SCHEMBL5714814 0.94 TP53 (0.47) SIGMAR1ADORA3HTR2AHTR7OPRM1
SCHEMBL5714786 0.93 SIGMAR1 (0.47) SIGMAR1ADORA3HTR2AHTR7OPRM1
SCHEMBL5714768 0.92 LIPE (0.46) HRH2HRH1
SCHEMBL5714850 0.92 ADORA3 (0.40) SIGMAR1ADORA3HTR2AHTR7OPRM1
SCHEMBL5714552 0.91 SIGMAR1 (0.41) SIGMAR1ADORA3HTR2AHTR7OPRM1
SCHEMBL5715302 0.91 SIGMAR1 (0.41) SIGMAR1ADORA3HTR2AHTR7OPRM1
SCHEMBL5715170 0.90 TRPV1 (0.43) SIGMAR1ADORA3HTR2AHTR7OPRM1

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 SIGMAR1 2726/4885ADORA3 3862/4885HTR2A 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.