SCHEMBL2773458

SCHEMBL2773458

Nc1ccc2c(c1)S(=O)(=O)N=CN2C1CC1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.32
CA9 Q16790 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.31
ABCC8 Q09428 1/20 0.31
KCNJ11 Q14654 1/20 0.31
GRIA1 P42261 3/20 0.31
GRIA2 P42262 3/20 0.31
GRIA3 P42263 3/20 0.31
GRIA4 P48058 3/20 0.31

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
SCHEMBL2776740 0.94 ABCC8 (0.34) CA12CA9CA1CA2ALDH1A1
SCHEMBL2777706 0.82 GRIA1 (0.31) CA1CA2GRIA1GRIA2GRIA3
SCHEMBL2179051 0.79 GRIA2 (0.45) CA2ALDH1A1HTTABCC8KCNJ11
SCHEMBL2777523 0.76 GRIA1 (0.33) GRIA1GRIA2GRIA3GRIA4
SCHEMBL2774471 0.73 GRIA1 (0.42) CA12CA9CA1CA2ABCC8
SCHEMBL2778463 0.73 GRIA2 (0.42) CA1CA2ALDH1A1GRIA1GRIA2
SCHEMBL2774129 0.71 CCNT1 (0.30)
SCHEMBL2776571 0.71 CCNT1 (0.33)
SCHEMBL2777136 0.68 GRIA1 (0.36) ALDH1A1ABCC8KCNJ11GRIA1GRIA2
SCHEMBL2777119 0.68 CHRNA1 (0.31) GRIA1GRIA2GRIA3GRIA4

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
EP-2147915-B1 New cycloalkylated benzothiadiazine derivatives, method of preparing same and pharmaceutical compositions containing them SERVIER LAB (FR) 2010-09-15 EP disclosed
US-7741320-B2 Cycloalkylated benzothiadiazines, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2010-06-22 US disclosed
EP-2147915-A1 New cycloalkylated benzothiadiazine derivatives, method of preparing same and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2010-01-27 EP disclosed
WO-2010004139-A1 NEW CYCLOALKYLATED BENZOTHIADIAZINE DERIVATIVES, METHOD FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM LES LABORATOIRES SERVIER (FR) 2010-01-14 WO disclosed
US-20100009974-A1 Cycloalkylated benzothiadiazines, a process for their preparation and pharmaceutical compostions containing them LES LABORATOIRES SERVIER (FR) 2010-01-14 US 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-20100009974-A1 Cycloalkylated benzothiadiazines, a process for their preparation and pharmaceutical compostions containing them ACLY, HCAR1, GABRG1 CA12 4272/4885CA9 3951/4885CA1 3557/4885

“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.