SCHEMBL5774764

SCHEMBL5774764

O=C(O)N1CCN(CCc2cnc3ccccc3n2)CC1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.60
PDE10A Q9Y233 4/20 0.51
HTR1A P08908 4/20 0.46
PTK2 Q05397 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KCNH2 Q12809 1/20 0.44
THRB P10828 2/20 0.44
HCAR2 Q8TDS4 1/20 0.41
DRD4 P21917 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL5660329 0.82 L3MBTL1 (0.50) FAAHPDE10AHTR1AHCAR2
SCHEMBL27269314 0.80 PDE10A (0.61) FAAHPDE10APTK2MEN1KMT2A
SCHEMBL7014186 0.80 FAAH (0.42) FAAHKCNH2
SCHEMBL1514937 0.78 FAAH (0.44) FAAHMEN1KMT2AKCNH2HCAR2
SCHEMBL5774709 0.76 PTK2 (0.53) FAAHHTR1APTK2DRD4NPC1
SCHEMBL3608360 0.75 FAAH (1.00) FAAH
SCHEMBL5776029 0.74 FAAH (0.46) FAAHHTR1APTK2MEN1KMT2A
SCHEMBL2927709 0.74 MEN1 (0.73) FAAHHTR1AMEN1KMT2AKCNH2
SCHEMBL5318658 0.73 NPC1 (0.68) MEN1KMT2AHCAR2NPC1RAB9A
SCHEMBL5709396 0.72 PDE10A (0.67) PDE10AMEN1KMT2ANPC1RAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1343780-B1 PIPERAZINE DERIVATIVES FOR TREATMENT OF BACTERIAL INFECTIONS SMITHKLINE BEECHAM PLC (GB) 2006-09-20 EP claimed
US-20040077655-A1 Piperazine derivatives for treatment of bacterial infections SMITHKLINE BEECHAM P.L.C. (GB) 2004-04-22 US claimed
EP-1343780-B1 PIPERAZINE DERIVATIVES FOR TREATMENT OF BACTERIAL INFECTIONS SMITHKLINE BEECHAM PLC (GB) 2006-09-20 EP disclosed
US-20040077655-A1 Piperazine derivatives for treatment of bacterial infections SMITHKLINE BEECHAM P.L.C. (GB) 2004-04-22 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-20040077655-A1 Piperazine derivatives for treatment of bacterial infections MYD88, THPO, PIGO FAAH 2541/4885PDE10A 2419/4885HTR1A 4043/4885

“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.