SCHEMBL5883363

SCHEMBL5883363

Cc1ncsc1CCN1CCN(C(=O)Oc2ccc(N3C(=O)CC(C)(C)CC3=O)cn2)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.37
DRD2 P14416 1/20 0.37
HTR2A P28223 1/20 0.37
CYP4F2 P78329 1/20 0.35
PKM P14618 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
ALDH1A1 P00352 4/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GFER P55789 1/20 0.33
MAPT P10636 2/20 0.33
KCNH2 Q12809 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HRH2 P25021 2/20 0.32
HRH1 P35367 2/20 0.32

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
SCHEMBL5715294 0.87 HTR1A (0.38) HTR1ADRD2HTR2ACYP4F2THRB
SCHEMBL5715197 0.84 XIAP (0.37) HTR1ADRD2HTR2ACYP4F2CNR1
SCHEMBL5714669 0.84 KMT2A (0.36) CYP4F2PKMALDH1A1MEN1KMT2A
SCHEMBL6099834 0.84 CYP3A4 (0.39) CYP4F2PKMALDH1A1MEN1KMT2A
SCHEMBL5714763 0.83 CYP4F2 (0.36) CYP4F2PKMALDH1A1MEN1KMT2A
SCHEMBL6103192 0.81 KCNH2 (0.36) HTR1ACYP4F2PKMALDH1A1KCNH2
SCHEMBL5716201 0.81 CYP4F2 (0.36) HTR1ADRD2HTR2ACYP4F2PKM
SCHEMBL5714878 0.81 TP53 (0.44) ALDH1A1KCNH2SIGMAR1CYP2D6CYP2C19
SCHEMBL6102543 0.81 CYP4F2 (0.34) HTR1ACYP4F2PKMALDH1A1MEN1
SCHEMBL5714397 0.81 PKM (0.36) CYP4F2PKMALDH1A1MEN1KMT2A

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 3 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
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 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.