SCHEMBL6732406

SCHEMBL6732406

Cc1cccc(C2=C(c3cc(F)c(S(C)(=O)=O)cc3F)CC=C2)n1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.33
CCR8 P51685 1/20 0.33
PTGS2 P35354 1/20 0.32
NR1H2 P55055 2/20 0.32
NR1H3 Q13133 2/20 0.32
THRB P10828 2/20 0.32
TGFBR1 P36897 3/20 0.32
GPR119 Q8TDV5 1/20 0.31
GHSR Q92847 2/20 0.30
KDR P35968 1/20 0.30
MAPK14 Q16539 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
SCHEMBL6734177 0.80 VSIR (0.33) PTGS2GPR119
SCHEMBL6735316 0.80 TGFBR1 (0.35) CCR1CCR8PTGS2THRBTGFBR1
SCHEMBL6729921 0.80 NR1H2 (0.35) PTGS2NR1H2NR1H3
SCHEMBL6729491 0.80 NR1H2 (0.35) PTGS2NR1H2NR1H3
SCHEMBL6733002 0.79 ACLY (0.41) PTGS2NR1H2NR1H3
SCHEMBL6734903 0.78 PTGS2 (0.40) PTGS2NR1H2NR1H3
SCHEMBL6732652 0.78 PTGS2 (0.45) PTGS2
SCHEMBL6732768 0.78 GLA (0.32) NR1H2NR1H3
SCHEMBL6732991 0.77 PTGS2 (0.41) CCR1CCR8PTGS2TGFBR1
SCHEMBL6739952 0.76 RAB9A (0.38) PTGS2NR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040138261-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-07-15 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 CCR1 38/4885CCR8 234/4885PTGS2 10/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 CCR1 38/4885CCR8 234/4885PTGS2 10/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 CCR1 38/4885CCR8 234/4885PTGS2 10/4885

“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.