SCHEMBL9984680

SCHEMBL9984680

CN1C(C(=O)c2ccc3ccccc3c2)=C(OC(=O)COc2ccccc2)c2ccccc2S1(=O)=O

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 0.72
TP53 P04637 10/20 0.64
SMN1; SMN2 Q16637 7/20 0.58
KDM4E B2RXH2 1/20 0.58
LMNA P02545 1/20 0.58
HTT P42858 1/20 0.58
POLB P06746 2/20 0.57
GAA P10253 1/20 0.57
THRB P10828 1/20 0.57
HSD11B1 P28845 1/20 0.56

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
SCHEMBL9984557 0.94 MAPT (0.69) MAPTTP53SMN1; SMN2KDM4ELMNA
SCHEMBL9983609 0.93 MAPT (0.68) MAPTTP53SMN1; SMN2KDM4ELMNA
SCHEMBL9983406 0.90 MAPT (0.59) MAPTTP53SMN1; SMN2KDM4ELMNA
SCHEMBL9983988 0.88 MAPT (0.59) MAPTTP53SMN1; SMN2KDM4ELMNA
SCHEMBL9983497 0.88 MAPT (0.81) MAPTTP53SMN1; SMN2KDM4ELMNA
SCHEMBL9983349 0.87 HSD11B1 (0.59) MAPTTP53SMN1; SMN2KDM4ELMNA
SCHEMBL12041852 0.87 HSD11B1 (0.67) MAPTTP53SMN1; SMN2POLBGAA
SCHEMBL9983636 0.86 MAPT (0.67) MAPTTP53SMN1; SMN2KDM4ELMNA
SCHEMBL12041846 0.86 HSD11B1 (0.61) MAPTTP53SMN1; SMN2KDM4ELMNA
SCHEMBL12041807 0.85 MAPT (0.74) MAPTTP53SMN1; SMN2POLBHSD11B1

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
US-9187438-B2 Derivatives of benzothiazines, preparation thereof and application thereof as drugs PIERRE FABRE MEDICAMENT (FR) 2015-11-17 US claimed
EP-2403840-B1 DERIVATIVES OF BENZOTHIAZINES, PREPARATION THEREOF AND APPLICATION THEREOF AS DRUGS PF MEDICAMENT (FR) 2014-05-14 EP claimed
US-20110319326-A1 DERIVATIVES OF BENZOTHIAZINES, PREPARATION THEREOF AND APPLICATION THEREOF AS DRUGS PIERRE FABRE MEDICAMENT (FR) 2011-12-29 US claimed
EP-2403840-B1 DERIVATIVES OF BENZOTHIAZINES, PREPARATION THEREOF AND APPLICATION THEREOF AS DRUGS PF MEDICAMENT (FR) 2014-05-14 EP 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-20110319326-A1 DERIVATIVES OF BENZOTHIAZINES, PREPARATION THEREOF AND APPLICATION THEREOF AS DRUGS HSD11B1, CYP11B1, HSD17B11 MAPT 4086/4885TP53 3851/4885SMN1; SMN2 3970/4885

“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.