SCHEMBL6659189

SCHEMBL6659189

NC(=O)c1nn(-c2ccc(S(N)(=O)=O)cc2)c2c1CCc1sccc1-2

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 13/20 0.64
CDK2 P24941 13/20 0.64
CCNA1 P78396 13/20 0.64
IKBKB O14920 1/20 0.64
PTGS2 P35354 3/20 0.51
PTGS1 P23219 2/20 0.51
AURKA O14965 1/20 0.50
CA1 P00915 4/20 0.49
CA2 P00918 4/20 0.49
CA4 P22748 4/20 0.49
CA9 Q16790 4/20 0.49

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
SCHEMBL6660718 0.85 CA9 (0.55) CCNA2CDK2CCNA1IKBKBPTGS2
SCHEMBL13238794 0.84 PTGS2 (0.47) CCNA2CDK2CCNA1IKBKBPTGS2
SCHEMBL14747600 0.81 PTGS2 (0.69) PTGS2PTGS1
SCHEMBL5334053 0.78 CCNA2 (0.62) CCNA2CDK2CCNA1IKBKBPTGS2
SCHEMBL6794909 0.78 CCNA2 (0.62) CCNA2CDK2CCNA1IKBKBPTGS2
SCHEMBL5227494 0.78 CCNA2 (1.00) CCNA2CDK2CCNA1IKBKB
SCHEMBL6791456 0.78 CCNA2 (0.62) CCNA2CDK2CCNA1IKBKBPTGS2
SCHEMBL6663541 0.78 CCNA2 (0.65) CCNA2CDK2CCNA1IKBKBPTGS2
SCHEMBL8937493 0.76 PTGS2 (0.69) CCNA2CDK2CCNA1IKBKBPTGS2
SCHEMBL5335359 0.75 CCNA2 (0.58) CCNA2CDK2CCNA1IKBKBPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100215759-A1 PHARMACEUTICAL COMPOUNDS NEUROSCIENZE PHARMANESS S.C.A.R.L. (IT) 2010-08-26 US disclosed
US-20100215759-A1 PHARMACEUTICAL COMPOUNDS NEUROSCIENZE PHARMANESS S.C.A.R.L. (IT) 2010-08-26 US disclosed
EP-1476431-A1 TRICYCLIC PYRAZOLE DERIVATIVES FOR THE TREATMENT OF INFLAMMATION Pharmacia Corporation (US) 2004-11-17 EP disclosed
WO-2003070706-A1 TRICYCLIC PYRAZOLE DERIVATIVES FOR THE TREATMENT OF INFLAMMATION PHARMACIA CORPORATION (US) 2003-08-28 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-20100215759-A1 PHARMACEUTICAL COMPOUNDS CNR2, CNR1, OPRK1 CCNA2 645/4885CDK2 294/4885CCNA1 859/4885

“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.