SCHEMBL4891619

SCHEMBL4891619

CC(C)(C)c1cc(-c2ccc(C#N)cc2)cc(S(=O)(=O)O)c1O

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.45
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
MMP3 P08254 3/20 0.41
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HSD11B1 P28845 7/20 0.37
PTPN5 P54829 1/20 0.35
MMP1 P03956 2/20 0.35
MMP2 P08253 2/20 0.35
MMP7 P09237 2/20 0.35
MMP9 P14780 2/20 0.35
MMP13 P45452 2/20 0.35

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
SCHEMBL29022938 0.85 CA2 (0.61) KIF11CA1CA2MMP3CA12
SCHEMBL14023341 0.79 SLC22A12 (0.55)
SCHEMBL4890245 0.78 MCL1 (0.54)
SCHEMBL4894398 0.76 CA1 (0.44) KIF11CA1CA2CYP1A2CYP2C9
SCHEMBL4895823 0.75 CA2 (0.50) CA1CA2CYP1A2CYP2C9CYP2C19
SCHEMBL6451480 0.73 CA2 (0.50) KIF11CA1CA2MMP3CA12
SCHEMBL26179236 0.72 KIF11 (0.60) KIF11CA1CA2MMP3CA12
SCHEMBL6026961 0.72 CA12 (0.45) KIF11CA1CA2MMP3CA12
SCHEMBL8368664 0.70 CA2 (0.45) CA1CA2CYP1A2CYP2C9CYP2C19
SCHEMBL6026956 0.69 KIF11 (0.51) KIF11CA1CA2MMP3CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255240-A1 Sulfonamide Derivatives NOVO NORDISK A/S (DK) 2008-10-16 US claimed
EP-1756025-A1 SULFONAMIDE DERIVATIVES NOVO NORDISK A/S (DK) 2007-02-28 EP claimed
WO-2005105712-A1 SULFONAMIDE DERIVATIVES NOVO NORDISK A/S (DK) 2005-11-10 WO claimed
US-20080255240-A1 Sulfonamide Derivatives NOVO NORDISK A/S (DK) 2008-10-16 US disclosed
EP-1756025-A1 SULFONAMIDE DERIVATIVES NOVO NORDISK A/S (DK) 2007-02-28 EP disclosed
WO-2005105712-A1 SULFONAMIDE DERIVATIVES NOVO NORDISK A/S (DK) 2005-11-10 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-20080255240-A1 Sulfonamide Derivatives FABP4, SQOR, CS KIF11 4443/4885CA1 3874/4885CA2 1064/4885

“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.