SCHEMBL5265663

SCHEMBL5265663

COc1ccc(-n2nc(C(=O)N3CCC(F)(F)CC3)cc2-c2cc[nH]c2)nn1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 2/20 0.39
▸ KDM1A O60341 2/20 0.37
▸ MGLL Q99685 3/20 0.37
▸ ALOX5 P09917 2/20 0.36
▸ GABRA1 P14867 1/20 0.36
▸ PTGS2 P35354 4/20 0.35
▸ MALT1 Q9UDY8 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CCKAR P32238 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SCN9A Q15858 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
SCHEMBL5269617 0.89 MGLL (0.48) MGLLALOX5PTGS2MALT1HPGD
SCHEMBL5268500 0.87 PTGS2 (0.48) MGLLPTGS2HPGDMEN1MAPT
SCHEMBL5269315 0.86 CHRNA7 (0.38) CHRNA7KDM1AMGLLALOX5GABRA1
SCHEMBL5269952 0.85 MGLL (0.39) MGLLALOX5PTGS2MALT1HPGD
SCHEMBL5269005 0.84 GABRA1 (0.51) CHRNA7KDM1AALOX5GABRA1PTGS2
SCHEMBL5265857 0.83 GABRA1 (0.41) CHRNA7KDM1AMGLLALOX5GABRA1
SCHEMBL14529499 0.82 ALOX5 (0.33) ALOX5
SCHEMBL5267517 0.81 RPA1 (0.46) MEN1MAPTKMT2A
SCHEMBL5271855 0.81 GABRA1 (0.42) CHRNA7KDM1AALOX5GABRA1HPGD
SCHEMBL2916627 0.81 ABL1 (0.38) MGLLGABRA1HPGD

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-20070254881-A1 Pyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 — — US disclosed
US-20070254881-A1 Pyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 — — US disclosed
EP-1785418-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-05-16 — — 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-20070254881-A1 Pyrazole Derivative PTGER1, PTGS1, PTGER2 CHRNA7 4207/4885KDM1A 1118/4885MGLL 4176/4885

“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.

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