SCHEMBL6389296

SCHEMBL6389296

NS(=O)(=O)c1ccc(-n2nc(C(F)(F)F)cc2O)cc1F

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.61
PTGS1 P23219 4/20 0.51

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
SCHEMBL6409589 0.83 PTGS2 (0.75) PTGS2PTGS1
SCHEMBL5422320 0.82 PTGS2 (0.67) PTGS2PTGS1
SCHEMBL6722703 0.81 PTGS2 (0.78) PTGS2PTGS1
SCHEMBL6726597 0.80 PTGS2 (0.74) PTGS2PTGS1
SCHEMBL6721381 0.79 PTGS2 (0.79) PTGS2PTGS1
SCHEMBL6821187 0.79 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL6389023 0.79 PTGS2 (0.60) PTGS2PTGS1
SCHEMBL6723191 0.77 PTGS2 (0.73) PTGS2PTGS1
SCHEMBL6729026 0.77 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL6950710 0.76 PTGS2 (0.71) PTGS2PTGS1

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-6878726-B2 Pyrazole ether derivatives as anti-inflammatory/analgesic agents PFIZER INC. (US) 2005-04-12 US disclosed
US-20050004135-A1 Pyrazole ether derivatives as anti-inflammatory/analgesic agents CHENG HENGMAIO (US) 2005-01-06 US disclosed
US-20040259879-A1 Pyrazole ether derivatives as anti-inflammatory/analgesic agents CHENG HENGMAIO (US) 2004-12-23 US disclosed
EP-1259504-A1 PYRAZOLE ETHER DERIVATIVES AS ANTI-INFLAMMATORY/ANALGESIC AGENTS Pfizer Products Inc. (US) 2002-11-27 EP disclosed
US-20020058681-A1 Pyrazole ether derivatives as anti-inflammatory/analgesic agents PFIZER INC. 2002-05-16 US disclosed
WO-2001064669-A1 PYRAZOLE ETHER DERIVATIVES AS ANTI-INFLAMMATORY/ANALGESIC AGENTS PFIZER PRODUCTS INC. (US) 2001-09-07 WO 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 (3 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-20020058681-A1 Pyrazole ether derivatives as anti-inflammatory/analgesic agents PTGER3, PTGER1, P2RX3 PTGS2 96/4885PTGS1 34/4885
US-20050004135-A1 Pyrazole ether derivatives as anti-inflammatory/analgesic agents P2RX3, P2RX7, PTGER3 PTGS2 257/4885PTGS1 124/4885
US-20040259879-A1 Pyrazole ether derivatives as anti-inflammatory/analgesic agents PTGER3, PTGER1, P2RX3 PTGS2 96/4885PTGS1 34/4885

“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.