SCHEMBL5715077

SCHEMBL5715077

CC1(C)CC(=O)N(CCc2ccc(OC(=O)N3CCN(Cc4cnccn4)CC3)nc2)C(=O)C1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.39
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTR1A P08908 2/20 0.35
DRD2 P14416 1/20 0.35
HTR2A P28223 1/20 0.35
THRB P10828 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP4F2 P78329 1/20 0.34
TNKS O95271 1/20 0.33
PARP1 P09874 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33

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
SCHEMBL5714777 0.91 MGLL (0.40) MGLLKDM4EALDH1A1THRB
SCHEMBL5714637 0.90 ALDH1A1 (0.48) KDM4EALDH1A1HTR1ADRD2HTR2A
SCHEMBL5715404 0.89 KDM4E (0.36) KDM4EALDH1A1HTR1ADRD2HTR2A
SCHEMBL5714582 0.88 KDM4E (0.43) KDM4EALDH1A1DRD2
SCHEMBL5715300 0.87 HTR1A (0.40) KDM4EALDH1A1HTR1ADRD2HTR2A
SCHEMBL5714515 0.85 TP53 (0.43) KDM4EALDH1A1HTR1ADRD2HTR2A
SCHEMBL5713966 0.85 MGLL (0.41) MGLLKDM4EALDH1A1DRD2MEN1
SCHEMBL5714874 0.85 KDM4E (0.45) KDM4EALDH1A1HTR1ADRD2HTR2A
SCHEMBL5714476 0.85 HRH3 (0.36) KDM4EALDH1A1HTR1ADRD2HTR2A
SCHEMBL5715203 0.85 KDM4E (0.37) KDM4EALDH1A1HTR1ADRD2HTR2A

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 5 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

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 MGLL 32/4885KDM4E 1090/4885ALDH1A1 1504/4885

“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.