SCHEMBL801402

SCHEMBL801402

CCCNS(=O)(=O)c1cc(C)ccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.52
CA12 O43570 2/20 0.48
CA9 Q16790 2/20 0.48
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KMT2A Q03164 3/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
MEP1B Q16820 1/20 0.42
GAA P10253 2/20 0.42
MEN1 O00255 1/20 0.42
G6PD P11413 1/20 0.42
F10 P00742 2/20 0.41
ALDH1A1 P00352 3/20 0.41
TSHR P16473 1/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41

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
SCHEMBL801417 0.83 TDP1 (0.62) POLBTDP1L3MBTL1HTTSMN1; SMN2
SCHEMBL10868958 0.78 GAA (0.48) TDP1L3MBTL1SMN1; SMN2KMT2AGAA
SCHEMBL32664450 0.78 GAA (0.48) TDP1L3MBTL1SMN1; SMN2KMT2AGAA
SCHEMBL10700475 0.77 POLB (0.63) POLBL3MBTL1HTTSMN1; SMN2KMT2A
SCHEMBL7834037 0.74 ALDH1A1 (0.48) POLBCA12CA9TDP1L3MBTL1
SCHEMBL1913786 0.74 CA12 (0.49) POLBCA12CA9TDP1HTT
SCHEMBL16261330 0.74 CNR2 (0.50) POLBCA12CA9L3MBTL1HTT
SCHEMBL9001242 0.73 TRPA1 (0.52) POLBTDP1L3MBTL1KMT2AGAA
SCHEMBL634316 0.72 ALDH1A1 (0.71) CA12CA9L3MBTL1HTTSMN1; SMN2
SCHEMBL789348 0.72 POLB (0.44) POLBCA12CA9TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8569285-B2 Dihydrobenzoxathiazepine compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2013-10-29 US disclosed
US-20120071462-A1 Dihydrobenzoxathiazepine compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2012-03-22 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-20120071462-A1 Dihydrobenzoxathiazepine compounds, a process for their preparation and pharmaceutical compositions containing them GABRA1, GRM1, GABRA5 POLB 1452/4885CA12 3268/4885CA9 3732/4885

“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.