SCHEMBL2086706

SCHEMBL2086706

NC(=O)C1(NC(=O)c2cnn3c(-c4ccc(Cl)cc4F)c(-c4ccccc4Cl)cnc23)CCS(=O)(=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 4/20 0.38
PDE10A Q9Y233 3/20 0.38
DGAT2 Q96PD7 10/20 0.36
CNR1 P21554 2/20 0.35
MAPK11 Q15759 1/20 0.34
MAPK14 Q16539 1/20 0.34
DPP4 P27487 1/20 0.34
PTGES O14684 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33

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
SCHEMBL2085357 0.93 PDE2A (0.38) PDE2APDE10ADGAT2IRAK4
SCHEMBL2083600 0.91 DGAT2 (0.43) PDE2APDE10ADGAT2
SCHEMBL2085533 0.89 CNR1 (0.41) DGAT2CNR1MAPK11MAPK14PTGES
SCHEMBL2084818 0.84 GPR119 (0.38) PDE2ACNR1
SCHEMBL2085529 0.82 CNR1 (0.41) CNR1MAPK11MAPK14
SCHEMBL2083403 0.82 DGAT2 (0.42) PDE2ADGAT2
SCHEMBL4120372 0.80 DGAT2 (0.47) DGAT2
SCHEMBL4120368 0.80 DGAT2 (0.47) DGAT2
SCHEMBL2085923 0.79 DHODH (0.42) DPP4IRAK4
SCHEMBL11923813 0.77 DGAT2 (0.37) DGAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8921380-B2 Pyrazolo[1,5-a] pyrimidine compounds as CB1 receptor antagonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-12-30 US disclosed
EP-2035427-B1 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST MITSUBISHI TANABE PHARMA CORP (JP) 2013-12-11 EP disclosed
EP-2520577-A1 Pyrazolo[1,5-a]pyrimidine compounds as CB1 receptor antagonists Mitsubishi Tanabe Pharma Corporation (JP) 2012-11-07 EP disclosed
US-20120202992-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST TANIMOTO KOICHI (JP) 2012-08-09 US disclosed
US-8163759-B2 Pyrazolo[1,5-A] pyrimidine compounds as CB1 receptor antagonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-04-24 US disclosed
US-20090258867-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-15 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-20120202992-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST CNR1, CNR2, CCKAR PDE2A 2016/4885PDE10A 967/4885DGAT2 3629/4885
US-20090258867-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST CNR1, CNR2, CCKAR PDE2A 2496/4885PDE10A 1287/4885DGAT2 3457/4885

“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.