SCHEMBL5714536

SCHEMBL5714536

Cn1ccnc1SCc1ccc(OC(=O)N2CCN(CCc3cccnc3)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
POLB P06746 4/20 0.42
THRB P10828 2/20 0.42
HDAC1 Q13547 1/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 1/20 0.40
DRD2 P14416 2/20 0.39
DRD3 P35462 1/20 0.39
HRH2 P25021 1/20 0.38
HRH1 P35367 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
LTA4H P09960 1/20 0.38
HTR1A P08908 1/20 0.38
ADORA3 P0DMS8 1/20 0.37
HTR2A P28223 1/20 0.37
HTR7 P34969 1/20 0.37
OPRM1 P35372 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL5714687 0.95 SMN1; SMN2 (0.45) SMN1; SMN2POLBHDAC1KDM4EALDH1A1
SCHEMBL5715606 0.93 THRB (0.42) POLBTHRBKDM4EALDH1A1DRD2
SCHEMBL5714499 0.92 KDM4E (0.49) SMN1; SMN2POLBHDAC1KDM4EALDH1A1
SCHEMBL5714040 0.88 SIGMAR1 (0.46) KDM4EALDH1A1DRD2HRH2HRH1
SCHEMBL5714851 0.86 KDM4E (0.48) POLBKDM4EALDH1A1LMNA
SCHEMBL5715293 0.85 TP53 (0.49) SMN1; SMN2POLBTHRBHDAC1KDM4E
SCHEMBL5715376 0.83 SMN1; SMN2 (0.46) SMN1; SMN2POLBTHRBHDAC1ALDH1A1
SCHEMBL5714366 0.83 SMN1; SMN2 (0.46) SMN1; SMN2POLBTHRBHDAC1DRD2
SCHEMBL5714712 0.83 SMN1; SMN2 (0.47) SMN1; SMN2POLBHDAC1KDM4EALDH1A1
SCHEMBL5715066 0.83 SMN1; SMN2 (0.45) SMN1; SMN2POLBTHRBHDAC1KDM4E

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 SMN1; SMN2 3125/4885POLB 2674/4885THRB 598/4885

“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.