SCHEMBL4474160

SCHEMBL4474160

CCN1CCN(c2ccccc2CC2CCNC2=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.39
DRD2 P14416 4/20 0.37
DRD3 P35462 4/20 0.37
HTR6 P50406 2/20 0.37
HRH3 Q9Y5N1 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
TSHR P16473 1/20 0.37
HTR2C P28335 4/20 0.36
HTR1A P08908 2/20 0.36
DRD4 P21917 2/20 0.36
HTR2A P28223 2/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PLA2G1B P04054 1/20 0.35
RAB9A P51151 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35

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
SCHEMBL1737562 0.88 NCF1 (0.46) DRD2DRD3HTR6KMT2AMEN1
SCHEMBL5611262 0.88 NCF1 (0.46) DRD2DRD3HTR6KMT2AMEN1
SCHEMBL4732267 0.88 NCF1 (0.46) DRD2DRD3HTR6KMT2AMEN1
SCHEMBL1740973 0.85 HTR1A (0.47) DRD2DRD3HTR6TSHRHTR2C
SCHEMBL4480301 0.83 NCF1 (0.54) DRD2DRD3KMT2AMEN1HTR2C
SCHEMBL4477924 0.81 NCF1 (0.47) DRD2DRD3KMT2AMEN1HTR2C
SCHEMBL4475156 0.78 PTGER3 (0.33) KMT2AMEN1
SCHEMBL27686595 0.74
SCHEMBL4467894 0.72 PTGER3 (0.41) DRD2DRD3KMT2ATSHRHTR2C
SCHEMBL4479143 0.72 MAPT (0.39) DRD2DRD3HTR1ADRD4KDM4E

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
US-7479559-B2 3-[-2-(Piperazin-1-yl)benzyl]pyrrolidin-2-one derivatives; antidepressants, anxiolytic agents; obsessive compulsive disorder, psychological disorders, phobias; 5-HT1 agonist or antagonists; side effect reduction, in particular cardiac QTc prolongation; hydrogenation PFIZER INC. (US) 2009-01-20 US disclosed
CN-1934081-A Novel benayl(idene)-lactam derivatives PFIZER (US) 2007-03-21 CN disclosed
US-20050245521-A1 Novel benayl(idene)-lactam derivatives PFIZER INC. 2005-11-03 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-20050245521-A1 Novel benayl(idene)-lactam derivatives HTR1E, HTR1D, HTR1A CHRNA7 76/4885DRD2 69/4885DRD3 78/4885

“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.