SCHEMBL2918178

SCHEMBL2918178

CCOC(=O)c1cc(-c2cccc(OC)c2)n(-c2ccc(OC)nc2)n1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.58
MGLL Q99685 3/20 0.53
CA9 Q16790 2/20 0.52
PTGS2 P35354 3/20 0.49
PTGS1 P23219 2/20 0.49
RPA1 P27694 1/20 0.47
CCKAR P32238 1/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CSNK1D P48730 1/20 0.46
CHRNA7 P36544 2/20 0.46

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
SCHEMBL2919398 0.91 CA9 (0.52) FAAHMGLLCA9RPA1CHRNA7
SCHEMBL2918939 0.90 CA9 (0.63) FAAHMGLLCA9RPA1CHRNA7
SCHEMBL2916095 0.89 CHRNA7 (0.52) FAAHMGLLCA9PTGS2PTGS1
SCHEMBL2921056 0.89 CA9 (0.54) FAAHCA9PTGS2RPA1CHRNA7
SCHEMBL5522388 0.88 CA9 (0.49) FAAHMGLLCA9PTGS2PTGS1
SCHEMBL2915937 0.87 RPA1 (0.63) FAAHPTGS2RPA1CCKAR
SCHEMBL2915848 0.86 CA9 (0.63) FAAHMGLLCA9PTGS2PTGS1
SCHEMBL2917961 0.85 CA9 (0.54) FAAHCA9PTGS2RPA1CHRNA7
SCHEMBL14504359 0.85 CA9 (0.54) FAAHMGLLCA9PTGS2RPA1
SCHEMBL2920727 0.84 JMJD6 (0.46) FAAHCA9KDM4EALDH1A1CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1591443-B1 PYRAZOLE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2010-08-25 EP disclosed
US-7622471-B2 Pyrazole derivatives having a pyridazine and pyridine functionality DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-11-24 US disclosed
US-7622471-B2 Pyrazole derivatives having a pyridazine and pyridine functionality DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-11-24 US disclosed
US-20060128685-A1 Pyrazole derivative DAIICHI PHARMACEUTICAL CO., LTD., (JP) 2006-06-15 US disclosed
EP-1591443-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-02 EP 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-20060128685-A1 Pyrazole derivative PTGS1, PTGS2, PTGER1 FAAH 1345/4885MGLL 2165/4885CA9 2908/4885

“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.