SCHEMBL2777088

SCHEMBL2777088

NS(=O)(=O)c1cc(Cl)c(Cl)cc1NC1CCCC1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 15/20 0.63
▸ CA2 P00918 15/20 0.63
▸ CA6 P23280 14/20 0.63
▸ CA7 P43166 14/20 0.63
▸ CA5B Q9Y2D0 13/20 0.63
▸ CA12 O43570 13/20 0.63
▸ CA9 Q16790 12/20 0.63
▸ CA14 Q9ULX7 12/20 0.63
▸ CA13 Q8N1Q1 11/20 0.63
▸ CA3 P07451 9/20 0.63
▸ CA4 P22748 8/20 0.63
▸ CISD1 Q9NZ45 1/20 0.63
▸ CA5A P35218 12/20 0.54
▸ MEN1 O00255 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ KMT5B Q4FZB7 1/20 0.42
▸ KMT5C Q86Y97 1/20 0.42
▸ YAP1 P46937 1/20 0.42

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
SCHEMBL2776111 0.98 CA1 (0.65) CA1CA2CA6CA7CA5B
SCHEMBL2773999 0.98 CA1 (0.65) CA1CA2CA6CA7CA5B
SCHEMBL2776863 0.98 CA1 (0.65) CA1CA2CA6CA7CA5B
SCHEMBL2774475 0.97 CA1 (0.59) CA1CA2CA6CA7CA5B
SCHEMBL2775613 0.93 CA1 (0.55) CA1CA2CA6CA7CA5B
SCHEMBL2776617 0.81 CA1 (0.53) CA1CA2CA6CA7CA5B
SCHEMBL2774627 0.81 CA1 (0.53) CA1CA2CA6CA7CA5B
SCHEMBL2777101 0.81 PTGES2 (0.48) CA1CA2CA6CA7CA5B
SCHEMBL2775765 0.81 CA1 (0.50) CA1CA2CA6CA7CA5B
SCHEMBL2777720 0.80 CA1 (0.55) CA1CA2CA6CA7CA5B

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 CA1 3557/4885CA2 1509/4885CA6 3942/4885

“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.

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