SCHEMBL11957715

SCHEMBL11957715

CC(=O)N1CCN(c2ccc(Cl)cc2Cl)C(c2ccc(Cl)cc2)C1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 12/20 0.56
CNR1 P21554 3/20 0.45
DPP4 P27487 1/20 0.43
NOTUM Q6P988 1/20 0.43
ALDH1A1 P00352 2/20 0.43
AKR1C3 P42330 1/20 0.42
CNR2 P34972 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL11958151 0.89 MDM2 (0.57) MDM2CNR1NOTUMAKR1C3CNR2
SCHEMBL11957919 0.86 MDM2 (0.56) MDM2CNR1
SCHEMBL11957901 0.85 MDM2 (0.54) MDM2CNR1NOTUMALDH1A1
SCHEMBL11957804 0.85 MDM2 (0.45) MDM2CNR1DPP4NOTUMALDH1A1
SCHEMBL11958618 0.85 MDM2 (0.54) MDM2CNR1NOTUMAKR1C3CNR2
SCHEMBL11958580 0.85 MDM2 (0.52) MDM2CNR1NOTUMAKR1C3
SCHEMBL11957898 0.85 MDM2 (0.60) MDM2CNR1NOTUMALDH1A1AKR1C3
SCHEMBL11958616 0.85 MDM2 (0.54) MDM2CNR1NOTUMAKR1C3CNR2
SCHEMBL11957958 0.85 MDM2 (0.60) MDM2CNR1NOTUM
SCHEMBL11958154 0.84 MDM2 (0.53) MDM2CNR1NOTUMALDH1A1AKR1C3

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 MDM2 4116/4885CNR1 1/4885DPP4 2186/4885
US-20100029607-A1 Substituted Piperazines as CB1 Antagonists CNR1, CNR2, GPR119 MDM2 4116/4885CNR1 1/4885DPP4 2186/4885

“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.