SCHEMBL11957741

SCHEMBL11957741

Fc1ccc(CN2CCN(c3ccc(Cl)cc3Cl)C(c3ccc(Cl)cc3)C2)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.54
MAPT P10636 1/20 0.46
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
DRD4 P21917 3/20 0.42
MDM2 Q00987 1/20 0.41
DRD2 P14416 2/20 0.41
CCR1 P32246 1/20 0.41
GAA P10253 1/20 0.40
PRCP P42785 1/20 0.40
FADS1 O60427 1/20 0.39
NPY2R P49146 1/20 0.39

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
SCHEMBL11957982 0.94 CNR1 (0.57) CNR1MAPTSLC6A2SLC6A4SLC6A3
SCHEMBL11958325 0.92 CNR1 (0.62) CNR1MAPTDRD4MDM2DRD2
SCHEMBL11957716 0.92 CNR1 (0.62) CNR1MAPTDRD4MDM2DRD2
SCHEMBL11957812 0.92 CNR1 (0.51) CNR1MAPTSLC6A2SLC6A4SLC6A3
SCHEMBL11958072 0.90 CNR1 (0.54) CNR1MAPTDRD4MDM2DRD2
SCHEMBL11958116 0.90 CNR1 (0.52) CNR1SLC6A2SLC6A4SLC6A3MDM2
SCHEMBL11980185 0.90 CNR1 (0.52) CNR1SLC6A2SLC6A4SLC6A3MDM2
SCHEMBL11957740 0.89 CNR1 (0.48) CNR1MDM2NPY2R
SCHEMBL11980141 0.88 CNR1 (0.49) CNR1SLC6A2SLC6A4DRD4MDM2
SCHEMBL11957773 0.88 CNR1 (0.49) CNR1DRD4MDM2DRD2

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
US-20130072468-A1 SUBSTITUTED PIPERAZINES AS CB1 ANTAGONISTS GILBERT ERIC J (US) 2013-03-21 US disclosed
US-8236805-B2 Substituted piperazines as CB1 antagonists INTERVET INC. (US) 2012-08-07 US disclosed
US-8236805-B2 Substituted piperazines as CB1 antagonists INTERVET INC. (US) 2012-08-07 US disclosed
US-7700597-B2 Substituted piperazines as CB1 antagonists SCHERING CORPORATION (US) 2010-04-20 US disclosed
US-7700597-B2 Substituted piperazines as CB1 antagonists SCHERING CORPORATION (US) 2010-04-20 US disclosed
US-20100029607-A1 Substituted Piperazines as CB1 Antagonists SCHERING CORPORATION 2010-02-04 US disclosed
US-20100029607-A1 Substituted Piperazines as CB1 Antagonists SCHERING CORPORATION 2010-02-04 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 (2 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-20130072468-A1 SUBSTITUTED PIPERAZINES AS CB1 ANTAGONISTS CNR1, CNR2, GPR119 CNR1 1/4885MAPT 1481/4885SLC6A2 1000/4885
US-20100029607-A1 Substituted Piperazines as CB1 Antagonists CNR1, CNR2, GPR119 CNR1 1/4885MAPT 1481/4885SLC6A2 1000/4885

“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.