SCHEMBL5266652

SCHEMBL5266652

CCOC(=O)c1cc(-c2cnc(NC(=O)OC(C)(C)C)cn2)n(-c2ccc(OC)nc2)n1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 3/20 0.38
FAAH O00519 8/20 0.38
CHRNA7 P36544 2/20 0.37
MKNK2 Q9HBH9 1/20 0.37
JMJD6 Q6NYC1 1/20 0.35
MGLL Q99685 3/20 0.35
POLB P06746 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PTK2B Q14289 1/20 0.34

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
SCHEMBL5267961 0.89 RPA1 (0.39) KMT2APTK2B
SCHEMBL5269108 0.88 CA9 (0.43) CA9FAAHCHRNA7MKNK2JMJD6
SCHEMBL5523473 0.88 FAAH (0.35) FAAHPTK2B
SCHEMBL5526891 0.87 PTK2B (0.33) PTK2B
SCHEMBL4931448 0.86 KMT2A (0.46) CA9FAAHMGLLPOLBTP53
SCHEMBL5266524 0.83 CA9 (0.44) CA9FAAHCHRNA7JMJD6MGLL
SCHEMBL5268263 0.83 MGLL (0.40) MGLLTP53
SCHEMBL5267493 0.82 PTGS2 (0.43) MGLLMAPTKMT2A
SCHEMBL5265523 0.82 CFTR (0.39) MGLL
SCHEMBL5268146 0.82 HPGD (0.39) CHRNA7MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070254881-A1 Pyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 US disclosed
US-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
EP-1785418-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-05-16 EP disclosed
EP-1698626-A1 AMIDOPYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-09-06 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 (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-20070254881-A1 Pyrazole Derivative PTGER1, PTGS1, PTGER2 CA9 3231/4885FAAH 1657/4885CHRNA7 4207/4885
US-20070219210-A1 Amidopyrazole Derivative PTGER1, PTGS1, PTGER2 CA9 3499/4885FAAH 63/4885CHRNA7 4667/4885

“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.