SCHEMBL5714752

SCHEMBL5714752

Cc1ccc(CCCN2CCN(C(=O)Oc3ccc(Oc4ccc(Cl)cn4)cc3)CC2)nc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 1/20 0.44
HRH1 P35367 1/20 0.44
LIPE Q05469 10/20 0.43
BCHE P06276 1/20 0.42
HRH3 Q9Y5N1 1/20 0.41
KCNA5 P22460 1/20 0.41
P2RX3 P56373 2/20 0.39
RXRB P28702 2/20 0.39
DRD2 P14416 1/20 0.38

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
SCHEMBL5714913 0.95 LIPE (0.44) HRH2HRH1LIPEBCHEHRH3
SCHEMBL5715432 0.89 HRH3 (0.44) HRH2HRH1LIPEBCHEHRH3
SCHEMBL5715138 0.87 LIPE (0.61) LIPEBCHE
SCHEMBL5714834 0.86 THRB (0.46) LIPEBCHE
SCHEMBL5714424 0.86 HRH2 (0.43) HRH2HRH1LIPEBCHEHRH3
SCHEMBL5714786 0.83 SIGMAR1 (0.47) HRH2HRH1DRD2
SCHEMBL5714958 0.82 SIGMAR1 (0.44) HRH2HRH1DRD2
SCHEMBL5714859 0.81 LIPE (0.63) LIPEBCHE
SCHEMBL5714070 0.81 THRB (0.52) LIPEBCHE
SCHEMBL5715168 0.80 LIPE (0.43) HRH2HRH1LIPEBCHEHRH3

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 HRH2 589/4885HRH1 602/4885LIPE 1/4885

“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.