SCHEMBL6733537

SCHEMBL6733537

CS(=O)(=O)c1cc(F)c(-c2nc(C(F)F)[nH]c2-c2cc(Cl)cc(Cl)c2)cc1F

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 4/20 0.33
PTGS2 P35354 3/20 0.32
PTGS1 P23219 2/20 0.32
ALOX5 P09917 1/20 0.31
APP P05067 2/20 0.31
CCR2 P41597 1/20 0.30
EPAS1 Q99814 1/20 0.30
BRAF P15056 1/20 0.30
AKR1C3 P42330 1/20 0.30
AKR1C2 P52895 1/20 0.30

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
SCHEMBL6736934 0.91 PTGS2 (0.42) TYK2PTGS2PTGS1ALOX5CCR2
SCHEMBL6733333 0.91 IDO1 (0.39) TYK2PTGS2ALOX5
SCHEMBL6732502 0.88 ALOX5 (0.34) TYK2PTGS2PTGS1ALOX5
SCHEMBL6732359 0.88 ALOX5 (0.35) PTGS2PTGS1ALOX5
SCHEMBL6729043 0.87 KDM4E (0.33) TYK2PTGS2PTGS1ALOX5
SCHEMBL6732424 0.87 SCN9A (0.38) TYK2PTGS2PTGS1ALOX5APP
SCHEMBL6739660 0.86 ALDH1A1 (0.43) PTGS2PTGS1ALOX5
SCHEMBL6739670 0.86 TYK2 (0.33) TYK2PTGS2PTGS1ALOX5
SCHEMBL6731912 0.86 ALOX5 (0.44) PTGS2PTGS1ALOX5
SCHEMBL6729810 0.86 PTGS2 (0.42) TYK2PTGS2PTGS1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6699884-B2 ANTIINFLAMMATORY CYCLOOXYGENASE INHIBITORS. PHARMACIA CORPORATION 2004-03-02 US claimed
US-20040138261-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-07-15 US disclosed
US-6699884-B2 ANTIINFLAMMATORY CYCLOOXYGENASE INHIBITORS. PHARMACIA CORPORATION 2004-03-02 US disclosed
US-6673818-B2 TREATING CYCLOOXYGENASE-2 MEDIATED DISORDERS, SUCH AS ARTHRITIS, PAIN, FEVER AND CANCER PHARMACIA CORPORATION 2004-01-06 US disclosed
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-08-07 US disclosed
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-02-13 US disclosed
EP-1251126-A2 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation Pharmacia Corporation (US) 2002-10-23 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 (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-20040138261-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 TYK2 552/4885PTGS2 10/4885PTGS1 4/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 TYK2 552/4885PTGS2 10/4885PTGS1 4/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 TYK2 552/4885PTGS2 10/4885PTGS1 4/4885

“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.