SCHEMBL6351573

SCHEMBL6351573

CS(=O)(=O)c1ccc(-c2[nH]c3ccccc3c2-c2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 17/20 1.00
ESR1 P03372 3/20 0.67
ESR2 Q92731 3/20 0.67

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
SCHEMBL6350326 1.00 PTGS2 (1.00) PTGS2ESR1ESR2
SCHEMBL6342283 0.91 PTGS2 (1.00) PTGS2
SCHEMBL3248532 0.90 PTGS2 (1.00) PTGS2
SCHEMBL3244795 0.90 PTGS2 (1.00) PTGS2
SCHEMBL6342907 0.90 PTGS2 (1.00) PTGS2
SCHEMBL6354448 0.90 PTGS2 (1.00) PTGS2
SCHEMBL8304225 0.88 PTGS2 (0.78) PTGS2
SCHEMBL6341317 0.88 PTGS2 (1.00) PTGS2
SCHEMBL6351545 0.86 PTGS2 (1.00) PTGS2
SCHEMBL27432266 0.86 PTGS2 (0.76) PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6960611-B2 Sulfonyl-containing 2,3-diarylindole compounds, methods for making same, and methods of use thereof INSTITUTE OF MATERIA MEDICA (CN) 2005-11-01 US claimed
US-20040058977-A1 Sulfonyl-containing 2,3-diarylindole compounds, methods for making same, and methods of use thereof INSTITUTE OF MATERIA MEDIC, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2004-03-25 US claimed
CN-1127482-C Sulfuryl diphenyl indole compound and preparation process and use in medicine INST OF MEDICINE CHINESE ACADE (CN) 2003-11-12 CN claimed
CN-1333206-A Sulfuryl diphenyl indole compound and preparation process and use in medicine INST OF MEDICINE CHINESE ACADE (CN) 2002-01-30 CN claimed
EP-0915848-A1 1,2-DIARYLINDOLE AS COX-2 INHIBITORS LABORATOIRES UPSA (FR) 1999-05-19 EP claimed
WO-1998005639-A1 1,2-DIARYLINDOLE AS COX-2 INHIBITORS LABORATOIRES UPSA (FR) 1998-02-12 WO claimed
US-6960611-B2 Sulfonyl-containing 2,3-diarylindole compounds, methods for making same, and methods of use thereof INSTITUTE OF MATERIA MEDICA (CN) 2005-11-01 US disclosed
US-20040058977-A1 Sulfonyl-containing 2,3-diarylindole compounds, methods for making same, and methods of use thereof INSTITUTE OF MATERIA MEDIC, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2004-03-25 US disclosed
CN-1127482-C Sulfuryl diphenyl indole compound and preparation process and use in medicine INST OF MEDICINE CHINESE ACADE (CN) 2003-11-12 CN disclosed
CN-1333206-A Sulfuryl diphenyl indole compound and preparation process and use in medicine INST OF MEDICINE CHINESE ACADE (CN) 2002-01-30 CN disclosed
EP-0915848-A1 1,2-DIARYLINDOLE AS COX-2 INHIBITORS LABORATOIRES UPSA (FR) 1999-05-19 EP disclosed
WO-1998005639-A1 1,2-DIARYLINDOLE AS COX-2 INHIBITORS LABORATOIRES UPSA (FR) 1998-02-12 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 (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-20040058977-A1 Sulfonyl-containing 2,3-diarylindole compounds, methods for making same, and methods of use thereof PTGS2, PTGES2, PTGER2 PTGS2 1/4885ESR1 3049/4885ESR2 487/4885

“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.