SCHEMBL3655412

SCHEMBL3655412

CS(=O)(=O)c1cccc(-c2cccc(C(N)=O)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CAMKK2 Q96RR4 2/20 0.55
ADAMTS4 O75173 1/20 0.50
PARP1 P09874 4/20 0.49
PTGS2 P35354 1/20 0.48
ERN1 O75460 2/20 0.48
GAA P10253 1/20 0.47
VNN1 O95497 1/20 0.46
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
LOXL2 Q9Y4K0 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
DHODH Q02127 1/20 0.45
CSF1R P07333 1/20 0.45
FLT1 P17948 1/20 0.45
FLT3 P36888 1/20 0.45

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
SCHEMBL1397448 0.90 GAA (0.55) PARP1GAAVNN1ALDH1A1LMNA
SCHEMBL29503163 0.90 GAA (0.55) PARP1GAAVNN1ALDH1A1LMNA
SCHEMBL3727018 0.89 PTGS2 (0.60) CAMKK2ADAMTS4PARP1PTGS2ERN1
SCHEMBL28078713 0.85 CA2 (0.54) ADAMTS4PARP1ERN1GAACA12
SCHEMBL4252833 0.85 KMO (0.59) CAMKK2PTGS2GAAALDH1A1LMNA
SCHEMBL31422694 0.82 PARP1 (0.64) PARP1ERN1DHODH
SCHEMBL6243674 0.82 KCNH2 (0.50) PTGS2LOXL2
SCHEMBL2431097 0.82 PARP1 (0.64) PARP1ERN1DHODH
SCHEMBL4581084 0.81 CAMKK2 (0.48) CAMKK2PARP1PTGS2VNN1FLT3
SCHEMBL13702345 0.81 SMN1; SMN2 (0.54) CAMKK2PTGS2GAAALDH1A1SMN1; SMN2

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
EP-2205556-A2 BIARYL SULFONAMIDE DERIVATIVES F. Hoffmann-Roche AG (CH) 2010-07-14 EP disclosed
WO-2009040289-A2 BIARYL SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-04-02 WO disclosed
US-20090088459-A1 NOVEL BIARYL SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-04-02 US disclosed
WO-2007067836-A2 SUBSTITUTED PYRAZOLE COMPOUNDS USEFUL AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-06-14 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-20090088459-A1 NOVEL BIARYL SULFONAMIDE DERIVATIVES NR1H3, NR1H2, NR1H4 CAMKK2 2239/4885ADAMTS4 4841/4885PARP1 4311/4885

“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.