SCHEMBL5714760

SCHEMBL5714760

O=C(Oc1ccc(N2C(=O)C3CCCCC3C2=O)cn1)N1CCN(CCCc2cccnc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
ALOX15 P16050 1/20 0.45
PTAFR P25105 1/20 0.42
CHRM3 P20309 4/20 0.41
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
FAAH O00519 1/20 0.38
MGLL Q99685 1/20 0.38
HTR1A P08908 1/20 0.38
DRD4 P21917 1/20 0.38
HTR2A P28223 1/20 0.38
HTR7 P34969 1/20 0.38
DRD3 P35462 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
SCHEMBL5714486 0.95 KDM4E (0.45) KDM4EALDH1A1ALOX15CHRM3KMT2A
SCHEMBL5714634 0.90 KDM4E (0.47) KDM4EALDH1A1KMT2AL3MBTL1
SCHEMBL5714854 0.86 THRB (0.41) KDM4EALDH1A1CHRM3KMT2AL3MBTL1
SCHEMBL6103020 0.83 KDM4E (0.45) KDM4EALDH1A1ALOX15PTAFRSIGMAR1
SCHEMBL5715222 0.82 THRB (0.46) KDM4EALDH1A1KMT2AL3MBTL1SIGMAR1
SCHEMBL5715303 0.82 SMN1; SMN2 (0.36) KDM4EALDH1A1CHRM3KMT2AL3MBTL1
SCHEMBL5714497 0.82 ALDH1A1 (0.37) ALDH1A1KMT2AL3MBTL1FAAHMGLL
SCHEMBL6101871 0.81 ALDH1A1 (0.38) ALDH1A1CHRM3KMT2AL3MBTL1FAAH
SCHEMBL5714590 0.80 MGLL (0.37) KDM4EALDH1A1KMT2AL3MBTL1MGLL
SCHEMBL5714337 0.80 ALDH1A1 (0.42) ALDH1A1KMT2AL3MBTL1

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 KDM4E 1090/4885ALDH1A1 1504/4885ALOX15 580/4885

“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.