SCHEMBL6834757

SCHEMBL6834757

Cc1nc(-c2cccnc2-c2cc(S(N)(=O)=O)ccc2F)cs1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 7/20 0.45
CA2 P00918 7/20 0.45
SCN9A Q15858 3/20 0.44
PTGS2 P35354 3/20 0.41
BLM P54132 1/20 0.41
ACSS2 Q9NR19 2/20 0.39
CDK2 P24941 2/20 0.38
CDK4 P11802 1/20 0.38
PTGES2 Q9H7Z7 1/20 0.37
CCNT1 O60563 1/20 0.37
CDK1 P06493 1/20 0.37
CCNB1 P14635 1/20 0.37
CCNA2 P20248 1/20 0.37
CDK7 P50613 1/20 0.37
CDK9 P50750 1/20 0.37
CCNH P51946 1/20 0.37

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
SCHEMBL6749945 0.85 SCN9A (0.43) CA1CA2SCN9APTGS2PTGES2
SCHEMBL6834803 0.83 CA1 (0.46) CA1CA2PTGS2ACSS2CDK2
SCHEMBL6832966 0.82 CA1 (0.53) CA1CA2PTGS2BLMACSS2
SCHEMBL6837996 0.82 CA1 (0.47) CA1CA2PTGS2ACSS2CDK2
SCHEMBL6841185 0.82 PTGES2 (0.41) CA1CA2SCN9APTGS2BLM
SCHEMBL6749607 0.81 SCN9A (0.40) CA1CA2SCN9APTGS2BLM
SCHEMBL6718990 0.80 SCN9A (0.44) SCN9APTGS2BLMPTGES2
SCHEMBL6841826 0.78 PTGS2 (0.56) CA1CA2PTGS2CDK2CDK4
SCHEMBL6838830 0.78 CA1 (0.49) CA1CA2PTGS2CDK2CDK4
SCHEMBL6839563 0.77 PTGS2 (0.52) CA1CA2PTGS2

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 CA1 2085/4885CA2 3175/4885SCN9A 4450/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 CA1 2085/4885CA2 3175/4885SCN9A 4450/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 CA1 2085/4885CA2 3175/4885SCN9A 4450/4885

“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.